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shehanmakani/README.md 
[ SYSTEM_BOOT ] : SHEHAN_MAKANI.exe ── initializing...

Chemical Engineer · AI Engineer · Founder

Bridging molecular kinetics and autonomous software — the Software-to-Steel pipeline.

Pearl River, NY  ·  ChemeNova LLC  ·  ChemRich Global  ·  Tech MBA · NJIT

The Mission

Building autonomous R&D pipelines that convert complex simulations into physical industrial outcomes. I work at the intersection where a process engineer's intuition meets an AI architect's toolbox — replacing static chemical workflows with systems that design, validate, and optimize themselves.

This isn't AI applied to chemistry as a feature. It's chemistry reimagined as software.

What I'm Building

Project Role Status
IntelliForm™ Agentic formulation intelligence platform Active · ChemeNova
FormulAI Natural language → formulation engine Live v1.0
MaximusX Private GPU-accelerated AI edge node Pilot · Jetson Orin Nano
Formulation Time Machine Arrhenius kinetic lifecycle prediction Optimizing
Cheminformatics ML Kaggle portfolio · 6 notebooks Active
TradeBot Algorithmic trading system · Alpaca + Telegram Private

Technical Stack

CHEMICAL_DOMAIN  = ["Formulation Optimization", "Kinetic Modeling", "Green Chemistry",
                     "Specialty Chemical Operations", "Process Engineering"]

AI_ENGINEERING   = ["Agentic Workflows", "LangGraph", "Multi-Agent Orchestration",
                     "Prompt Engineering", "RAG Pipelines", "Predictive ML"]

CHEMINFORMATICS  = ["RDKit", "chemprop", "ADMET Prediction", "Molecular ML",
                     "Retrosynthesis", "Space Solar Materials"]

EDGE_STACK       = ["NVIDIA Jetson Orin Nano", "Raspberry Pi 5", "IIoT Sensors",
                     "Digital Twins", "PINNs", "FFT Vibration Analysis"]

LANGUAGES        = ["Python (primary)", "JavaScript", "Bash / Linux"]

PLATFORMS        = ["Vercel", "Docker", "PM2", "Cloudflare Tunnel", "Alpaca Markets"]

Domain Depth

10+ years across the specialty chemical value chain — from family manufacturing roots (Snow White Products, est. 1985) through pharmaceutical project management (RK Pharma · Stira Pharmaceuticals) to founding AI-native chemical companies.

Products shipped: Calcium Chloride FCC · D-Limonene · Sodium Benzoate · Propylene Glycol · IPA 99% · Citric Acid across India, the Middle East, and North America.

Research: Surrogate-assisted multi-objective optimization for chemical formulation · published RSC Digital Discovery · ORCID 0009-0005-6746-308X

Active Repositories

cheminformatics-ml ML notebooks for cheminformatics · SpaceChem-AI · ADMET · Retrosynthesis

Jupyter Notebook

FormulAI Premium AI formulation assistant · sustainability posture · regulatory alignment

JavaScript

MaximusX Local GPU AI stack · LangGraph supervisor · Context Membrane RAG

Python

Formulation-Time-Machine First-order kinetics + Arrhenius-based shelf life simulation

Python

gold-price-prediction Walk-forward CV · macro features · regime-switching ensemble

Jupyter Notebook

future-self-emulator Recursive agentic life-path simulation via decision intelligence

Python

Connect

LinkedIn  ·  Medium  ·  Portfolio  ·  ORCID  ·  about.me

Focus: Scaling the Software-to-Steel pipeline for advanced chemical manufacturing.

Pinned Loading

  1. MaximusX MaximusX Public

    A private, GPU-accelerated personal AI assistant built for privacy, automation, and control. Runs locally on NVIDIA Jetson Orin Nano with Raspberry Pi voice edge and Mac dashboard. Integrates RAG, …

    Python 1

  2. future-self-emulator future-self-emulator Public

    Simulate multiple life-path versions of yourself to make better long-term decisions using Agentic AI.

    Python

  3. FormulAI FormulAI Public

    FormulAI is a premium-feeling AI formulation assistant for specialty chemical R&D teams. A chemist describes a target product, tunes sustainability and cost posture, picks a regulatory region, and …

    JavaScript 1

  4. Formulation-Time-Machine Formulation-Time-Machine Public

    Formulation Time Machine is an AI-powered simulation framework designed to predict the lifecycle of complex chemical formulations. By applying first-order kinetics and Arrhenius-based temperature a…

    Python 1

  5. cheminformatics-ml cheminformatics-ml Public

    ML notebooks (Kaggle Contributions) for cheminformatics

    Jupyter Notebook 1

  6. gold-price-prediction gold-price-prediction Public

    Built a genuine next-day gold price forecasting system addressing the most common flaw in financial ML: same-day data leakage.

    Jupyter Notebook 1