From 2b66e2104d0ab4708ce465c68c3209aef747fbf0 Mon Sep 17 00:00:00 2001
From: "renovate[bot]" <29139614+renovate[bot]@users.noreply.github.com>
Date: Thu, 28 May 2026 02:33:30 +0000
Subject: [PATCH] Lock file maintenance

---
 pixi.lock | 170 +++++++++++++++++++++++++++---------------------------
 1 file changed, 85 insertions(+), 85 deletions(-)

diff --git a/pixi.lock b/pixi.lock
index 17ed545..5e31ba8 100644
--- a/pixi.lock
+++ b/pixi.lock
@@ -40,6 +40,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/11/8d/d2532ad2a603ca2b93ad9f5135732124e57811d0168155852f37fbce2458/pillow-12.2.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/2f/40/dc34d1a8d5f1e51fc64640b62b191684da52ca469da9cd74e84936ffa4a6/msgpack-1.1.2-cp314-cp314-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/5d/f7e914f7d9325abff4057cee62c0fa70263683189f774473cbfb534cd13b/matplotlib-3.10.9-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
@@ -47,7 +48,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/52/b5/b7cbae73988bf7868009980c66a5d74725c99d2e2f11e0a566d0219ae53d/mdanalysis-2.10.0-cp314-cp314-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
@@ -84,10 +84,10 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/22/71/201105712d0a2ff07b7873ed3c220292fb2ea5120603c00c4b634bcdafb3/msgpack-1.1.2-cp314-cp314-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/24/05/1af2c186174cc92dcab2233f327336058c077d38f6fe2aceb08e6ab4d509/scikit_learn-1.8.0-cp314-cp314-macosx_10_15_x86_64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/71/e0/fb22f797187d0be2270f83500aab851536101b254bfa1eae10795709d283/pillow-12.2.0-cp314-cp314-macosx_10_15_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl
@@ -128,12 +128,12 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1b/9f/38ff9e57a2eade7bf9dfee5eae17f39fc0e998658050279cbb14d97d36d9/msgpack-1.1.2-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/27/d2/23d25e3f247b328be58d04a4c9f894178a0d1eda7d42867cfb388adaf416/fonttools-4.63.0-cp314-cp314-macosx_10_15_universal2.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/41/86/86231232fff41c9f8e4a1a7d7a597d349a02527109c3af7d618366122139/matplotlib-3.10.9-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/49/b2/97980f3ad4fae37dd7fe31626e2bf75fbf8bdf5d303950ec1fab39a12da8/kiwisolver-1.5.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/5f/35/825d14ce918e3445e2f4da9dbc1488fcc77970031ed3e3fb5684fbf9753b/mdanalysis-2.10.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -173,11 +173,11 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1d/64/b14c5b438b6334a0d331ff88081c4dd0ca12f618e725610d3f3ebf6b8aed/mdanalysis-2.10.0-cp314-cp314-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4b/39/f0e8ea762a764a9dc52aa7dabcfad51a354819de1f0d4652b6a1122424d6/scipy-1.17.1-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6e/f1/abd09c2ae91228c5f3998dbd7f41353def9eac64253de3c8105efa2082f7/msgpack-1.1.2-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/76/18/a8def8f91b18cd1ba6e05dbe02540168cb24d47e8dcf69e8d00b7da42a08/scikit_learn-1.8.0-cp314-cp314-win_amd64.whl
@@ -230,6 +230,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/11/8d/d2532ad2a603ca2b93ad9f5135732124e57811d0168155852f37fbce2458/pillow-12.2.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/2f/40/dc34d1a8d5f1e51fc64640b62b191684da52ca469da9cd74e84936ffa4a6/msgpack-1.1.2-cp314-cp314-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/5d/f7e914f7d9325abff4057cee62c0fa70263683189f774473cbfb534cd13b/matplotlib-3.10.9-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
@@ -237,7 +238,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/52/b5/b7cbae73988bf7868009980c66a5d74725c99d2e2f11e0a566d0219ae53d/mdanalysis-2.10.0-cp314-cp314-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
@@ -272,10 +272,10 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/22/71/201105712d0a2ff07b7873ed3c220292fb2ea5120603c00c4b634bcdafb3/msgpack-1.1.2-cp314-cp314-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/24/05/1af2c186174cc92dcab2233f327336058c077d38f6fe2aceb08e6ab4d509/scikit_learn-1.8.0-cp314-cp314-macosx_10_15_x86_64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/71/e0/fb22f797187d0be2270f83500aab851536101b254bfa1eae10795709d283/pillow-12.2.0-cp314-cp314-macosx_10_15_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl
@@ -314,12 +314,12 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1b/9f/38ff9e57a2eade7bf9dfee5eae17f39fc0e998658050279cbb14d97d36d9/msgpack-1.1.2-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/27/d2/23d25e3f247b328be58d04a4c9f894178a0d1eda7d42867cfb388adaf416/fonttools-4.63.0-cp314-cp314-macosx_10_15_universal2.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/41/86/86231232fff41c9f8e4a1a7d7a597d349a02527109c3af7d618366122139/matplotlib-3.10.9-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/49/b2/97980f3ad4fae37dd7fe31626e2bf75fbf8bdf5d303950ec1fab39a12da8/kiwisolver-1.5.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/5f/35/825d14ce918e3445e2f4da9dbc1488fcc77970031ed3e3fb5684fbf9753b/mdanalysis-2.10.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -357,11 +357,11 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1d/64/b14c5b438b6334a0d331ff88081c4dd0ca12f618e725610d3f3ebf6b8aed/mdanalysis-2.10.0-cp314-cp314-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4b/39/f0e8ea762a764a9dc52aa7dabcfad51a354819de1f0d4652b6a1122424d6/scipy-1.17.1-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6e/f1/abd09c2ae91228c5f3998dbd7f41353def9eac64253de3c8105efa2082f7/msgpack-1.1.2-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/76/18/a8def8f91b18cd1ba6e05dbe02540168cb24d47e8dcf69e8d00b7da42a08/scikit_learn-1.8.0-cp314-cp314-win_amd64.whl
@@ -413,6 +413,9 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/11/8d/d2532ad2a603ca2b93ad9f5135732124e57811d0168155852f37fbce2458/pillow-12.2.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/1a/f8/7a441d780c42e858ad677c82bb54eb3f01b424b710a8db5b9a8782305326/prek-0.4.3-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
+      - pypi: https://files.pythonhosted.org/packages/1e/c0/56472c251d09858a53e51efbd485b09e1995d8731668b76d52e5dd6ee0f1/ruff-0.15.14-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/2f/40/dc34d1a8d5f1e51fc64640b62b191684da52ca469da9cd74e84936ffa4a6/msgpack-1.1.2-cp314-cp314-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/5d/f7e914f7d9325abff4057cee62c0fa70263683189f774473cbfb534cd13b/matplotlib-3.10.9-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
@@ -420,18 +423,15 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/52/b5/b7cbae73988bf7868009980c66a5d74725c99d2e2f11e0a566d0219ae53d/mdanalysis-2.10.0-cp314-cp314-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/b8/cb/861b41341d6f1245e6ca80b1c1a8c4dfce43255b03df034429089ca2a2c5/scikit_learn-1.8.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/c9/2a/ccd581b6222277a2aa095530844d5bb76db4547042f05a9cb649476bf904/prek-0.4.1-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/df/b2/87e62e8c3e2f4b32e5fe99e0b86d576da1312593b39f47d8ceef365e95ed/packaging-26.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/e7/f9/b06c934a6aa8bc91f566bd2a214fd04c30506c2d9e2b6b171953216a65b6/kiwisolver-1.5.0-cp314-cp314-manylinux2014_x86_64.manylinux_2_17_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/e8/31/bf1a0803d077e679cfeee5f2f67290a0fa79c7385b5d9a8c17b9db2c48f0/ruff-0.15.13-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/ec/57/56b9bcc3c9c6a792fcbaf139543cee77261f3651ca9da0c93f5c1221264b/python_dateutil-2.9.0.post0-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/f3/eb/ebffaa97dc55502df69584a8f0dcf07f69a3e0b3e2323670a2722db9aa39/numpy-2.4.6-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       osx-64:
@@ -457,18 +457,17 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/22/71/201105712d0a2ff07b7873ed3c220292fb2ea5120603c00c4b634bcdafb3/msgpack-1.1.2-cp314-cp314-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/24/05/1af2c186174cc92dcab2233f327336058c077d38f6fe2aceb08e6ab4d509/scikit_learn-1.8.0-cp314-cp314-macosx_10_15_x86_64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/37/4e/6a067f530194a6e4141c36463eece92356dfd7f924ffe0cbf456bdca723b/prek-0.4.1-py3-none-macosx_10_12_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/45/91/254a35c20acc38a7223c9d2d594af12e794432464f2cdeb52af1dc4a892d/ruff-0.15.14-py3-none-macosx_10_12_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/71/e0/fb22f797187d0be2270f83500aab851536101b254bfa1eae10795709d283/pillow-12.2.0-cp314-cp314-macosx_10_15_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/85/31/621980971edbed31c17f65209adc8da32a45aef0e3bb0a1f5ad2e150820e/mdanalysis-2.10.0-cp314-cp314-macosx_10_13_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/86/ca/caa871ee7be718c45256fada4e16a218ee3e33f0c4a46b729a60a24912e6/ruff-0.15.13-py3-none-macosx_10_12_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/c2/a7/78da680eadd06ff35edef6ef68a1ad273bad3e2a0936c9a885103230aece/kiwisolver-1.5.0-cp314-cp314-macosx_10_15_x86_64.whl
@@ -478,6 +477,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/df/b2/87e62e8c3e2f4b32e5fe99e0b86d576da1312593b39f47d8ceef365e95ed/packaging-26.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/ec/57/56b9bcc3c9c6a792fcbaf139543cee77261f3651ca9da0c93f5c1221264b/python_dateutil-2.9.0.post0-py2.py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/ef/55/937d707cc01d311e5c856c7019bc7db2c5e1835728396bb1ea32a7ecfdfd/prek-0.4.3-py3-none-macosx_10_12_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/f8/91/3ab2044d05fd16d343c5ac2e69b127f1b2854040dd20b193257c78028bd3/numpy-2.4.6-cp314-cp314-macosx_10_15_x86_64.whl
       osx-arm64:
       - conda: https://conda.anaconda.org/conda-forge/noarch/ca-certificates-2026.5.20-hbd8a1cb_0.conda
@@ -501,12 +501,13 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1b/9f/38ff9e57a2eade7bf9dfee5eae17f39fc0e998658050279cbb14d97d36d9/msgpack-1.1.2-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/27/d2/23d25e3f247b328be58d04a4c9f894178a0d1eda7d42867cfb388adaf416/fonttools-4.63.0-cp314-cp314-macosx_10_15_universal2.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/41/86/86231232fff41c9f8e4a1a7d7a597d349a02527109c3af7d618366122139/matplotlib-3.10.9-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/49/b2/97980f3ad4fae37dd7fe31626e2bf75fbf8bdf5d303950ec1fab39a12da8/kiwisolver-1.5.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/56/9e/d13e40f83b8d0a94430e6778ce1d94a43b38cf2efe63278bdd2b4c65abbf/ruff-0.15.14-py3-none-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/5f/35/825d14ce918e3445e2f4da9dbc1488fcc77970031ed3e3fb5684fbf9753b/mdanalysis-2.10.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -516,9 +517,8 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/ba/8c/1a9e46228571de18f8e28f16fabdfc20212a5d019f3e3303452b3f0a580d/pillow-12.2.0-cp314-cp314-macosx_11_0_arm64.whl
-      - pypi: https://files.pythonhosted.org/packages/d3/19/43f5f2e568dddde567fc41f8471f9432c09563e19d3e617a48cfa52f8f0a/ruff-0.15.13-py3-none-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/df/b2/87e62e8c3e2f4b32e5fe99e0b86d576da1312593b39f47d8ceef365e95ed/packaging-26.2-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/e3/3d/a334c0f5b88fadca888eadfc1fb3d7f1dc8358b1a534d0987339ecb8eb92/prek-0.4.1-py3-none-macosx_11_0_arm64.whl
+      - pypi: https://files.pythonhosted.org/packages/e1/6a/9a99ac481eb148dba55652df88b029ab6c1f90384bd51996026cdab2dafb/prek-0.4.3-py3-none-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/e7/05/c19819d5e3d95294a6f5947fb9b9629efb316b96de511b418c53d245aae6/cycler-0.12.1-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/ec/57/56b9bcc3c9c6a792fcbaf139543cee77261f3651ca9da0c93f5c1221264b/python_dateutil-2.9.0.post0-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/ed/a6/d05a85fd51daeb2e4ea71d102f15b34fedca8e931af02594193ae4fd25f7/scipy-1.17.1-cp314-cp314-macosx_12_0_arm64.whl
@@ -546,25 +546,25 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1d/64/b14c5b438b6334a0d331ff88081c4dd0ca12f618e725610d3f3ebf6b8aed/mdanalysis-2.10.0-cp314-cp314-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/32/5d/9f21aca8ccee6978db831dbf36c2e17461692c75dd291c9b3d170e39a82a/prek-0.4.3-py3-none-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4b/39/f0e8ea762a764a9dc52aa7dabcfad51a354819de1f0d4652b6a1122424d6/scipy-1.17.1-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6e/f1/abd09c2ae91228c5f3998dbd7f41353def9eac64253de3c8105efa2082f7/msgpack-1.1.2-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/76/18/a8def8f91b18cd1ba6e05dbe02540168cb24d47e8dcf69e8d00b7da42a08/scikit_learn-1.8.0-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7d/c2/57f54b03d0f22d4044b8afb9ca0e184f8b1afd57b4f735c2fa70883dc601/contourpy-1.3.3-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/89/12/d43daf290a73dbc3e1a3eabb9077e45df661923949bee045de67cbe82524/prek-0.4.1-py3-none-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/a3/36/4e551e8aa55c9188bca9abb5096805edbf7431072b76e2298e34fd3a3008/kiwisolver-1.5.0-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/ab/1a/5a4f747a8b271cbb024946d2dd3c913ab5032ba430626f8c3528ada96b4b/matplotlib-3.10.9-cp314-cp314-win_amd64.whl
-      - pypi: https://files.pythonhosted.org/packages/ab/a6/870a3e8a50590bb92be184ad928c2922f088b00d9dc5c5ec7b924ee08c22/ruff-0.15.13-py3-none-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/b4/d1/ebe68f13ea1444025bd1b45854f1a59d8f06af3498702f4e00ebd4a0e33e/conservedwatersearch-0.5.1-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/b7/ce/149a00dd41f10bc29e5921b496af8b574d8413afcd5e30dfa0ed46c2cc5e/six-1.17.0-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/c3/d4/98078064ccc76b45cb0f6c002452011e93c4bd26f6850344f0951cc1fe89/fonttools-4.63.0-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/cd/8b/601e6566b957ca50e28725cb6c355c59c2c8609751efbecd980db44e0349/pillow-12.2.0-cp314-cp314-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/d1/b7/4ea2c170f10ad760fff2a5250beb18897719dc8b52b53a24cddbb9dd3f19/ruff-0.15.14-py3-none-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/df/ac/46de6dda46478f7942f839e094970be2d4a861e005c4b3bf07c92e291a09/numpy-2.4.6-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/df/b2/87e62e8c3e2f4b32e5fe99e0b86d576da1312593b39f47d8ceef365e95ed/packaging-26.2-py3-none-any.whl
@@ -820,12 +820,12 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/11/be/8930c437148dd10f09c8c66d609647f19d7c065c4893bb99e3899148e3ed/mdanalysis-2.10.0-cp311-cp311-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/36/4d/4a67f30778a45d542bbea5db2dbfa1e9e100bf9ba64aefe34215ba9f11f6/scikit_learn-1.8.0-cp311-cp311-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/5f/4b/6157f24ca425b89fe2eb7e7be642375711ab671135be21e6faa100f7448c/contourpy-1.3.3-cp311-cp311-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/79/db/e28c1b83e3680740aa78925f5fb2ae4d16207207419ad75ea9fe604f8676/matplotlib-3.10.9-cp311-cp311-manylinux2014_x86_64.manylinux_2_17_x86_64.whl
@@ -863,6 +863,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/11/60/37b4047a2af0cf5ef6d8b4b26e91829ae6fc6a2d1f74524bcb0e7cd28a32/kiwisolver-1.5.0-cp311-cp311-macosx_10_9_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/2c/97/560d11202bcd537abca693fd85d81cebe2107ba17301de42b01ac1677b69/msgpack-1.1.2-cp311-cp311-macosx_10_9_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
@@ -870,7 +871,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/4c/8c/290f021104741fea63769c31494f5324c0cd249bf536a65a4350767b1f22/matplotlib-3.10.9-cp311-cp311-macosx_10_12_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/68/e1/748f5663efe6edcfc4e74b2b93edfb9b8b99b67f21a854c3ae416500a2d9/pillow-12.2.0-cp311-cp311-macosx_10_10_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -911,13 +911,13 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/0e/0d/f5957185c0ee2f3e12f78715aa9e3b353fd83633316c8532b38faa37e3f6/numpy-2.4.6-cp311-cp311-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/47/a1/d5ff69e747374c33a3b53b9f98cca7889fce1fd03d79cdc4e1bccc6c5a87/pillow-12.2.0-cp311-cp311-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/51/18/325cd32ece1120d1da51cc4e4294c6580190699490183fc2fe8cb6d61ec5/matplotlib-3.10.9-cp311-cp311-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6c/58/5876a6574fde15fd205138cb570460a01b14f4462b1c3305db62f5f0b284/mdanalysis-2.10.0-cp311-cp311-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/75/2b/a7f1545bdf5da69c4bda0cea2a5781f0ad2a6623e0277267672db43c5fe6/fonttools-4.63.0-cp311-cp311-macosx_10_9_universal2.whl
@@ -956,12 +956,12 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/2a/79/309d0e637f6f37e83c711f547308b91af02b72d2326ddd860b966080ef29/msgpack-1.1.2-cp311-cp311-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/56/76/a9925d9bcffb34f9acb162d400f4678356871112975c78452ac631bd04fe/mdanalysis-2.10.0-cp311-cp311-win_amd64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/69/42/836b6f3cd7f3e5fa10a1f1a5420447c17966044c8fbf589cc0452d5502db/pillow-12.2.0-cp311-cp311-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -1016,6 +1016,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/01/8e/1e35281b8ab6d5d72ebe9911edcdffa3f36b04ed9d51dec6dd140396e220/scipy-1.17.1-cp312-cp312-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/91/d024616abdba99e83120e07a20658976f6a343646710760c4a51df126029/matplotlib-3.10.9-cp312-cp312-manylinux2014_x86_64.manylinux_2_17_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
@@ -1023,7 +1024,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/4c/16/ad7fc0f8948075b9ab7f6957519492e861b2f16469f1ab0a916f7c3c4243/mdanalysis-2.10.0-cp312-cp312-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/65/92/a5100f7185a800a5d29f8d14041f61475b9de465ffcc0f3b9fba606e4505/msgpack-1.1.2-cp312-cp312-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/77/c7/2342da9830e3e9d4870305ca5d2091d2a83284f2953079b7bdd3b5e029d8/fonttools-4.63.0-cp312-cp312-manylinux2014_x86_64.manylinux_2_17_x86_64.whl
@@ -1061,6 +1061,7 @@ environments:
       - conda: https://conda.anaconda.org/conda-forge/osx-64/tk-8.6.13-h7142dee_3.conda
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/35/48/b992b488d6f299dbe3f11a20b24d3dda3d46f1a635ede1c46b5b17a7b163/scipy-1.17.1-cp312-cp312-macosx_10_14_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/35/c6/5581e26c72233ebb2a2a6fed2d24fb7c66b4700120b813f51b0555acf0b6/matplotlib-3.10.9-cp312-cp312-macosx_10_13_x86_64.whl
@@ -1070,7 +1071,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/57/8c/8d037a8010e92959631fa05811df43e4710b8e828bd18ea3da73189d5ce8/mdanalysis-2.10.0-cp312-cp312-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/58/be/7482c8a5ebebbc6470b3eb791812fff7d5e0216c2be3827b30b8bb6603ed/pillow-12.2.0-cp312-cp312-macosx_10_13_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
@@ -1108,6 +1108,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/08/ef/b3c6b9b5be2f82416d73fe2ed2e96e2793cd80e7510bd6a17ca79cdd88ec/fonttools-4.63.0-cp312-cp312-macosx_10_13_universal2.whl
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/34/68/ba4f155f793a74c1483d4bdef136e1023f7bcba557f0db4ef3db3c665cf1/msgpack-1.1.2-cp312-cp312-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
@@ -1115,7 +1116,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/53/3e/405b59cfa13021a56bba395a6b3aca8cec012b45bf177b0eaf7a202cde2c/contourpy-1.3.3-cp312-cp312-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
@@ -1155,12 +1155,12 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/19/e8/6026ed58a64563186a9ee3f29f41261fd1828f527dd93d33b60feca63352/contourpy-1.3.3-cp312-cp312-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/5d/7b/25a221d2c761c6a8ae21bfa3874988ff2583e19cf8a27bf2fee358df7942/pillow-12.2.0-cp312-cp312-win_amd64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/61/1e/9952ca31d73d21a01f3499228274ae637ad1ff2f678a935b39711fdc9898/mdanalysis-2.10.0-cp312-cp312-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -1211,6 +1211,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/2b/0a/7b98e1e119878a27ba8618ca1e18b14f992ff1eda40f47bccccf4de44121/kiwisolver-1.5.0-cp313-cp313-manylinux2014_x86_64.manylinux_2_17_x86_64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/38/cf/06896db3f71c75902a8e9943b444a56e727418f6b4b4a90c98c934f51ed4/scikit_learn-1.8.0-cp313-cp313-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
@@ -1218,7 +1219,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/5d/ba/459f18c16f2b3fc1a1ca871f72f07d70c07bf768ad0a507a698b8052ac58/msgpack-1.1.2-cp313-cp313-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/67/ee/21d4e8536afd1a328f01b359b4d3997b291ffd35a237c877b331c1c3b71c/pillow-12.2.0-cp313-cp313-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -1257,12 +1257,12 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/03/aa/e22e0768512ce9255eba34775be2e85c2048da73da1193e841707f8f039c/scikit_learn-1.8.0-cp313-cp313-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/34/46/6c717baadcd62bc8ed51d238d521ab651eaa74838291bda1f86fe1f864c9/pillow-12.2.0-cp313-cp313-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/68/35/0167aad910bbdb9599272bd96d01a9ec6852f36b9455cf2ca67bd4cc2d23/contourpy-1.3.3-cp313-cp313-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/6b/31/b46518ecc604d7edf3a4f94cb3bf021fc62aa301f0cb849936968164ef23/msgpack-1.1.2-cp313-cp313-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
@@ -1303,13 +1303,13 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1b/30/a80189bcc7f5e4258b3fbc3968d909d1756f54d023299ecc39ad6fdb9ef8/numpy-2.4.6-cp313-cp313-macosx_11_0_arm64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/58/0d/8572a9688ee913dbe3f5578b69dc8e4c58bcf086c7a8676ba99a61f9e8e0/mdanalysis-2.10.0-cp313-cp313-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/58/37/31b83b2594105f61a381fc74ca19e8780ee923be2d496fcd8d2e1147bd99/scikit_learn-1.8.0-cp313-cp313-macosx_12_0_arm64.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/63/d9/9e14bc7564bf92d5ffa801ae5fac819ce74b925dfb55e3ebde61a3bbad3e/matplotlib-3.10.9-cp313-cp313-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/71/43/905a14a8b17fdb1ccb58d282454490662d2cb89a6bfec26af6d3520da5ec/pillow-12.2.0-cp313-cp313-macosx_11_0_arm64.whl
@@ -1350,13 +1350,13 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/18/0b/0098c214843213759692cc638fce7de5c289200a830e5035d1791d7a2338/contourpy-1.3.3-cp313-cp313-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/1c/f9/9b7563caf3ec8873e17a31401858efab6b39a882daf6c1bfa88879c0aa11/scikit_learn-1.8.0-cp313-cp313-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/35/e5/d6d0e51fc888f692a35134336866341c08655d92614f492c6860dc45bb2c/scipy-1.17.1-cp313-cp313-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3f/82/8a3739a5e470b3c6cbb1d21d315800d8e16bff503d1f16b03a4ec3212786/pillow-12.2.0-cp313-cp313-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/74/07/1ed8277f8653c40ebc65985180b007879f6a836c525b3885dcc6448ae6cb/msgpack-1.1.2-cp313-cp313-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -1409,6 +1409,7 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/11/8d/d2532ad2a603ca2b93ad9f5135732124e57811d0168155852f37fbce2458/pillow-12.2.0-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/2f/40/dc34d1a8d5f1e51fc64640b62b191684da52ca469da9cd74e84936ffa4a6/msgpack-1.1.2-cp314-cp314-manylinux2014_x86_64.manylinux_2_17_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/5d/f7e914f7d9325abff4057cee62c0fa70263683189f774473cbfb534cd13b/matplotlib-3.10.9-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
@@ -1417,7 +1418,6 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/52/b5/b7cbae73988bf7868009980c66a5d74725c99d2e2f11e0a566d0219ae53d/mdanalysis-2.10.0-cp314-cp314-manylinux_2_24_x86_64.manylinux_2_28_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/81/47/dd9a212ef6e343a6857485ffe25bba537304f1913bdbed446a23f7f592e1/filelock-3.29.0-py3-none-any.whl
@@ -1455,11 +1455,11 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/22/71/201105712d0a2ff07b7873ed3c220292fb2ea5120603c00c4b634bcdafb3/msgpack-1.1.2-cp314-cp314-macosx_10_13_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/24/05/1af2c186174cc92dcab2233f327336058c077d38f6fe2aceb08e6ab4d509/scikit_learn-1.8.0-cp314-cp314-macosx_10_15_x86_64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/71/e0/fb22f797187d0be2270f83500aab851536101b254bfa1eae10795709d283/pillow-12.2.0-cp314-cp314-macosx_10_15_x86_64.whl
       - pypi: https://files.pythonhosted.org/packages/72/8b/4546f3ab60f78c514ffb7d01a0bd743f90de36f0019d1be84d0a708a580a/contourpy-1.3.3-cp314-cp314-macosx_10_13_x86_64.whl
@@ -1501,13 +1501,13 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1b/9f/38ff9e57a2eade7bf9dfee5eae17f39fc0e998658050279cbb14d97d36d9/msgpack-1.1.2-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/27/d2/23d25e3f247b328be58d04a4c9f894178a0d1eda7d42867cfb388adaf416/fonttools-4.63.0-cp314-cp314-macosx_10_15_universal2.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/41/86/86231232fff41c9f8e4a1a7d7a597d349a02527109c3af7d618366122139/matplotlib-3.10.9-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/49/b2/97980f3ad4fae37dd7fe31626e2bf75fbf8bdf5d303950ec1fab39a12da8/kiwisolver-1.5.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/5f/35/825d14ce918e3445e2f4da9dbc1488fcc77970031ed3e3fb5684fbf9753b/mdanalysis-2.10.0-cp314-cp314-macosx_11_0_arm64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/7b/91/984aca2ec129e2757d1e4e3c81c3fcda9d0f85b74670a094cc443d9ee949/joblib-1.5.3-py3-none-any.whl
@@ -1548,12 +1548,12 @@ environments:
       - pypi: https://files.pythonhosted.org/packages/10/bd/c038d7cc38edc1aa5bf91ab8068b63d4308c66c4c8bb3cbba7dfbc049f9c/pyparsing-3.3.2-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/16/e1/3079a9ff9b8e11b846c6ac5c8b5bfb7ff225eee721825310c91b3b50304f/tqdm-4.67.3-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/1d/64/b14c5b438b6334a0d331ff88081c4dd0ca12f618e725610d3f3ebf6b8aed/mdanalysis-2.10.0-cp314-cp314-win_amd64.whl
+      - pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/32/d5/f9a850d79b0851d1d4ef6456097579a9005b31fea68726a4ae5f2d82ddd9/threadpoolctl-3.6.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/3c/f1/efea3da858043ed9c078f507ab744b6d00933c7bc8a75a24821937600178/mmtf_python-1.1.3-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/4b/39/f0e8ea762a764a9dc52aa7dabcfad51a354819de1f0d4652b6a1122424d6/scipy-1.17.1-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/4f/4b/5fe3a00833a9f9775b3c237624a6212798167278ffe10fe0de04f58612d0/mda_xdrlib-0.2.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/54/20/4d324d65cc6d9205fabedc306948156824eb9f0ee1633355a8f7ec5c66bf/pluggy-1.6.0-py3-none-any.whl
-      - pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/6e/f1/abd09c2ae91228c5f3998dbd7f41353def9eac64253de3c8105efa2082f7/msgpack-1.1.2-cp314-cp314-win_amd64.whl
       - pypi: https://files.pythonhosted.org/packages/6f/cb/3f4ee8233f30c7926f1ed4885ff32b79ec7ce3210370f43e1cb2b385bed6/mrcfile-1.5.4-py2.py3-none-any.whl
       - pypi: https://files.pythonhosted.org/packages/76/18/a8def8f91b18cd1ba6e05dbe02540168cb24d47e8dcf69e8d00b7da42a08/scikit_learn-1.8.0-cp314-cp314-win_amd64.whl
@@ -3596,6 +3596,11 @@ packages:
   - pytest-xdist ; extra == 'test-no-images'
   - wurlitzer ; extra == 'test-no-images'
   requires_python: '>=3.11'
+- pypi: https://files.pythonhosted.org/packages/1a/f8/7a441d780c42e858ad677c82bb54eb3f01b424b710a8db5b9a8782305326/prek-0.4.3-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
+  name: prek
+  version: 0.4.3
+  sha256: e08595fe96d24c1fe13486b00d55ce73a7b37040a16e82365942606594c67a6b
+  requires_python: '>=3.8'
 - pypi: https://files.pythonhosted.org/packages/1b/30/a80189bcc7f5e4258b3fbc3968d909d1756f54d023299ecc39ad6fdb9ef8/numpy-2.4.6-cp313-cp313-macosx_11_0_arm64.whl
   name: numpy
   version: 2.4.6
@@ -3767,6 +3772,11 @@ packages:
   - pybtex-docutils ; extra == 'doc'
   - dask ; extra == 'parallel'
   requires_python: '>=3.11'
+- pypi: https://files.pythonhosted.org/packages/1e/c0/56472c251d09858a53e51efbd485b09e1995d8731668b76d52e5dd6ee0f1/ruff-0.15.14-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
+  name: ruff
+  version: 0.15.14
+  sha256: 715c543cf450c4888251f91c52f1942a800541d9bddd7ac060aa4e6b77ae7cba
+  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/22/71/201105712d0a2ff07b7873ed3c220292fb2ea5120603c00c4b634bcdafb3/msgpack-1.1.2-cp314-cp314-macosx_10_13_x86_64.whl
   name: msgpack
   version: 1.1.2
@@ -3912,6 +3922,17 @@ packages:
   version: 1.5.0
   sha256: 332b4f0145c30b5f5ad9374881133e5aa64320428a57c2c2b61e9d891a51c2f3
   requires_python: '>=3.10'
+- pypi: https://files.pythonhosted.org/packages/2c/27/9768d918c86ad720ea805ce21cb7ae33ab77e8ca92486ff3c2af5dd5e60b/griddataformats-1.2.0-py3-none-any.whl
+  name: griddataformats
+  version: 1.2.0
+  sha256: b42f0a823ce6f526c0052515047237b233748f2bdc38fc797fc37c7df81a8dd5
+  requires_dist:
+  - numpy>=1.21
+  - scipy
+  - mrcfile
+  - pytest ; extra == 'test'
+  - numpy ; extra == 'test'
+  requires_python: '>=3.11'
 - pypi: https://files.pythonhosted.org/packages/2c/7d/e8fa40165c3e84f179cc1176b43c0177de1507fb5f518e6c30ba9d1c7569/mdanalysis-2.9.0-cp310-cp310-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
   name: mdanalysis
   version: 2.9.0
@@ -4012,6 +4033,11 @@ packages:
   - pytest-xdist ; extra == 'test-no-images'
   - wurlitzer ; extra == 'test-no-images'
   requires_python: '>=3.10'
+- pypi: https://files.pythonhosted.org/packages/32/5d/9f21aca8ccee6978db831dbf36c2e17461692c75dd291c9b3d170e39a82a/prek-0.4.3-py3-none-win_amd64.whl
+  name: prek
+  version: 0.4.3
+  sha256: 798d04437d30d6b4e6c1d520fe6ca800c340c9246f0dc8900d8b365df54b71b6
+  requires_python: '>=3.8'
 - pypi: https://files.pythonhosted.org/packages/32/5d/f7e914f7d9325abff4057cee62c0fa70263683189f774473cbfb534cd13b/matplotlib-3.10.9-cp314-cp314-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
   name: matplotlib
   version: 3.10.9
@@ -4332,11 +4358,6 @@ packages:
   - skia-pathops>=0.5.0 ; extra == 'all'
   - uharfbuzz>=0.45.0 ; extra == 'all'
   requires_python: '>=3.10'
-- pypi: https://files.pythonhosted.org/packages/37/4e/6a067f530194a6e4141c36463eece92356dfd7f924ffe0cbf456bdca723b/prek-0.4.1-py3-none-macosx_10_12_x86_64.whl
-  name: prek
-  version: 0.4.1
-  sha256: b25807e0aa57d2118747e127b58e7a1bf41d5d7b3323f5f3f1f3cb10031245cc
-  requires_python: '>=3.8'
 - pypi: https://files.pythonhosted.org/packages/38/cf/06896db3f71c75902a8e9943b444a56e727418f6b4b4a90c98c934f51ed4/scikit_learn-1.8.0-cp313-cp313-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
   name: scikit-learn
   version: 1.8.0
@@ -4553,6 +4574,11 @@ packages:
   - skia-pathops>=0.5.0 ; extra == 'all'
   - uharfbuzz>=0.45.0 ; extra == 'all'
   requires_python: '>=3.10'
+- pypi: https://files.pythonhosted.org/packages/45/91/254a35c20acc38a7223c9d2d594af12e794432464f2cdeb52af1dc4a892d/ruff-0.15.14-py3-none-macosx_10_12_x86_64.whl
+  name: ruff
+  version: 0.15.14
+  sha256: be4ff55af755bd71a00ab3dc6bd7ffc467bd76e0df6881e286c2e3d23e8fb43b
+  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/47/a1/d5ff69e747374c33a3b53b9f98cca7889fce1fd03d79cdc4e1bccc6c5a87/pillow-12.2.0-cp311-cp311-macosx_11_0_arm64.whl
   name: pillow
   version: 12.2.0
@@ -5021,6 +5047,11 @@ packages:
   - pybtex-docutils ; extra == 'doc'
   - dask ; extra == 'parallel'
   requires_python: '>=3.11'
+- pypi: https://files.pythonhosted.org/packages/56/9e/d13e40f83b8d0a94430e6778ce1d94a43b38cf2efe63278bdd2b4c65abbf/ruff-0.15.14-py3-none-macosx_11_0_arm64.whl
+  name: ruff
+  version: 0.15.14
+  sha256: 48d5909d7d06276ce7dde6d32bfa4b0d4cb2651145cd8ee4b440722cbc77832f
+  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/57/8c/8d037a8010e92959631fa05811df43e4710b8e828bd18ea3da73189d5ce8/mdanalysis-2.10.0-cp312-cp312-macosx_10_13_x86_64.whl
   name: mdanalysis
   version: 2.10.0
@@ -5297,17 +5328,6 @@ packages:
   version: 1.1.2
   sha256: fac4be746328f90caa3cd4bc67e6fe36ca2bf61d5c6eb6d895b6527e3f05071e
   requires_python: '>=3.9'
-- pypi: https://files.pythonhosted.org/packages/5e/ed/139ce29a650d9d4d35ce78b3fc4741da3d2a6d0f4db7b88d5f4ffcff8c77/griddataformats-1.1.0-py3-none-any.whl
-  name: griddataformats
-  version: 1.1.0
-  sha256: d3dfc4d9f16d5e7bb4d387195434f24ef0339aa246ebfbf357fdfb4b26828385
-  requires_dist:
-  - numpy>=1.21
-  - scipy
-  - mrcfile
-  - pytest ; extra == 'test'
-  - numpy ; extra == 'test'
-  requires_python: '>=3.11'
 - pypi: https://files.pythonhosted.org/packages/5f/35/825d14ce918e3445e2f4da9dbc1488fcc77970031ed3e3fb5684fbf9753b/mdanalysis-2.10.0-cp314-cp314-macosx_11_0_arm64.whl
   name: mdanalysis
   version: 2.10.0
@@ -6144,11 +6164,6 @@ packages:
   - pybtex-docutils ; extra == 'doc'
   - dask ; extra == 'parallel'
   requires_python: '>=3.11'
-- pypi: https://files.pythonhosted.org/packages/86/ca/caa871ee7be718c45256fada4e16a218ee3e33f0c4a46b729a60a24912e6/ruff-0.15.13-py3-none-macosx_10_12_x86_64.whl
-  name: ruff
-  version: 0.15.13
-  sha256: 6590d009e7cb7ebf36f83dbdd44a3fa48a0994ff6f1cdc1b08006abe58f98dc7
-  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/87/36/cccb9bc2a6ab63d1b2980374f0dca72ce95ae267c9b4cfe77455bb70d0d4/fonttools-4.63.0-cp312-cp312-win_amd64.whl
   name: fonttools
   version: 4.63.0
@@ -6183,11 +6198,6 @@ packages:
   - skia-pathops>=0.5.0 ; extra == 'all'
   - uharfbuzz>=0.45.0 ; extra == 'all'
   requires_python: '>=3.10'
-- pypi: https://files.pythonhosted.org/packages/89/12/d43daf290a73dbc3e1a3eabb9077e45df661923949bee045de67cbe82524/prek-0.4.1-py3-none-win_amd64.whl
-  name: prek
-  version: 0.4.1
-  sha256: 8fa707971465d8ad021c907e43691aad7bb98942943e61e294ece5f95d9fbc78
-  requires_python: '>=3.8'
 - pypi: https://files.pythonhosted.org/packages/89/3c/45c352094cfa60050bcbb967b1faf246b22e93cb459f2f907b600f2ceda5/scikit_learn-1.8.0-cp311-cp311-win_amd64.whl
   name: scikit-learn
   version: 1.8.0
@@ -6976,11 +6986,6 @@ packages:
   - setuptools-scm>=7,<10 ; extra == 'dev'
   - setuptools>=64 ; extra == 'dev'
   requires_python: '>=3.10'
-- pypi: https://files.pythonhosted.org/packages/ab/a6/870a3e8a50590bb92be184ad928c2922f088b00d9dc5c5ec7b924ee08c22/ruff-0.15.13-py3-none-win_amd64.whl
-  name: ruff
-  version: 0.15.13
-  sha256: 7064884d442b7d477b4e7473d12da7f08851d2b1982763c5d3f388a19468a1a4
-  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/ab/ca/feab00bd44aa5fe1ad2c18f08b4d3bb92e26484b0b1d1443897809ed528c/numpy-2.4.6-cp312-cp312-win_amd64.whl
   name: numpy
   version: 2.4.6
@@ -7483,11 +7488,6 @@ packages:
   - pybtex-docutils ; extra == 'doc'
   - dask ; extra == 'parallel'
   requires_python: '>=3.11'
-- pypi: https://files.pythonhosted.org/packages/c9/2a/ccd581b6222277a2aa095530844d5bb76db4547042f05a9cb649476bf904/prek-0.4.1-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
-  name: prek
-  version: 0.4.1
-  sha256: 6e69a9c02ead38706a5d2a4ae209dccba08ccb5d0026e1d08e723c66ab964750
-  requires_python: '>=3.8'
 - pypi: https://files.pythonhosted.org/packages/c9/92/53ea2181da8ac6bf27170191028aee7251f8f841f8d3edbfdcaf2008fde9/scikit_learn-1.8.0-cp311-cp311-macosx_10_9_x86_64.whl
   name: scikit-learn
   version: 1.8.0
@@ -7774,16 +7774,16 @@ packages:
   - doit>=0.36.0 ; extra == 'dev'
   - pydevtool ; extra == 'dev'
   requires_python: '>=3.10'
+- pypi: https://files.pythonhosted.org/packages/d1/b7/4ea2c170f10ad760fff2a5250beb18897719dc8b52b53a24cddbb9dd3f19/ruff-0.15.14-py3-none-win_amd64.whl
+  name: ruff
+  version: 0.15.14
+  sha256: 802342981e056db3851a7836e5b070f8f15f67d4a685ae2a6160939d364b2902
+  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/d1/d6/3965ed04c63042e047cb6a3e6ed1a63a35087b6a609aa3a15ed8ac56c221/colorama-0.4.6-py2.py3-none-any.whl
   name: colorama
   version: 0.4.6
   sha256: 4f1d9991f5acc0ca119f9d443620b77f9d6b33703e51011c16baf57afb285fc6
   requires_python: '>=2.7,!=3.0.*,!=3.1.*,!=3.2.*,!=3.3.*,!=3.4.*,!=3.5.*,!=3.6.*'
-- pypi: https://files.pythonhosted.org/packages/d3/19/43f5f2e568dddde567fc41f8471f9432c09563e19d3e617a48cfa52f8f0a/ruff-0.15.13-py3-none-macosx_11_0_arm64.whl
-  name: ruff
-  version: 0.15.13
-  sha256: 1c26d2f66163deeb6e08d8b39fbbe983ce3c71cea06a6d7591cfd1421793c629
-  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/d4/24/a372aaf5c9b7208e7112038812994107bc65a84cd00e0354a88c2c77a617/pytest-9.0.3-py3-none-any.whl
   name: pytest
   version: 9.0.3
@@ -7955,10 +7955,10 @@ packages:
   version: '26.2'
   sha256: 5fc45236b9446107ff2415ce77c807cee2862cb6fac22b8a73826d0693b0980e
   requires_python: '>=3.8'
-- pypi: https://files.pythonhosted.org/packages/e3/3d/a334c0f5b88fadca888eadfc1fb3d7f1dc8358b1a534d0987339ecb8eb92/prek-0.4.1-py3-none-macosx_11_0_arm64.whl
+- pypi: https://files.pythonhosted.org/packages/e1/6a/9a99ac481eb148dba55652df88b029ab6c1f90384bd51996026cdab2dafb/prek-0.4.3-py3-none-macosx_11_0_arm64.whl
   name: prek
-  version: 0.4.1
-  sha256: efa95331c4c171a867c0064c19d8a4abc94a1c1c920c8b8092f2d7d87f4b90a8
+  version: 0.4.3
+  sha256: e99ee90a7b6e84dabef891ff7521eb59dae38953467bdb482f004ea522d3a64c
   requires_python: '>=3.8'
 - pypi: https://files.pythonhosted.org/packages/e5/4d/2c2f0069970b6907de8fb5b05c5c0193cc22f717df151d1c7aef1c738f58/fonttools-4.63.0-cp310-cp310-win_amd64.whl
   name: fonttools
@@ -8044,11 +8044,6 @@ packages:
   version: 1.5.0
   sha256: 80aa065ffd378ff784822a6d7c3212f2d5f5e9c3589614b5c228b311fd3063ac
   requires_python: '>=3.10'
-- pypi: https://files.pythonhosted.org/packages/e8/31/bf1a0803d077e679cfeee5f2f67290a0fa79c7385b5d9a8c17b9db2c48f0/ruff-0.15.13-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
-  name: ruff
-  version: 0.15.13
-  sha256: cc411dfebe5eebe55ce041c6ae080eb7668955e866daa2fbb16692a784f1c4ca
-  requires_python: '>=3.7'
 - pypi: https://files.pythonhosted.org/packages/e9/bd/e51a61b1054f09437acfbc2ff9106c30d1eb76bc1453d428399946781253/pillow-12.2.0-cp311-cp311-manylinux_2_27_x86_64.manylinux_2_28_x86_64.whl
   name: pillow
   version: 12.2.0
@@ -8181,6 +8176,11 @@ packages:
   - ruff>=0.12.0 ; extra == 'dev'
   - cython-lint>=0.12.2 ; extra == 'dev'
   requires_python: '>=3.11'
+- pypi: https://files.pythonhosted.org/packages/ef/55/937d707cc01d311e5c856c7019bc7db2c5e1835728396bb1ea32a7ecfdfd/prek-0.4.3-py3-none-macosx_10_12_x86_64.whl
+  name: prek
+  version: 0.4.3
+  sha256: b43a85f5ddf7827a75491e79ca068a49c5e4efde8dbac844ecb89622a78458e4
+  requires_python: '>=3.8'
 - pypi: https://files.pythonhosted.org/packages/ef/71/d935dc54e4ff121bfdd11e08702db63a7e6f25af21d8a3d7b7212df53641/fonttools-4.63.0-cp313-cp313-macosx_10_13_x86_64.whl
   name: fonttools
   version: 4.63.0