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MANADIP/README.md

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 About Me

name: Manadip Sutradhar
degree: M.Sc. Chemistry
institution: Indian Institute of Technology Guwahati
domains:
  - Computational Chemistry
  - Machine Learning for Chemistry
  - Materials Science & Informatics
  - AI-Driven Drug Discovery
  - Data Science & Analytics
currently:
  - Building ML models for molecular property prediction
  - Exploring AI applications in materials science
  - Contributing to open-source scientific tools
motto: "Where molecules meet machine learning"
Manadip Sutradhar



Manadip Sutradhar
M.Sc. Chemistry · IIT Guwahati


LinkedIn Email Portfolio


 Research Interests


 Tech Stack & Skills

💻 Programming & Frameworks

Languages

🤖 Machine Learning & AI

ML Frameworks

🧪 Computational Chemistry

🛠️ Tools & Platforms

Tools


 GitHub Analytics

GitHub Stats    Top Languages

GitHub Streak

Activity Graph

Trophies


 Featured Projects

🧬 Electron-Induced Dissociation in Halogenated DNA Base Pairs

Investigating electron attachment mechanisms and bond dissociation pathways in halogenated nucleobases using ab initio quantum chemistry methods.

🤖 Molecular Property Prediction using ML

Machine learning pipeline for predicting molecular properties from SMILES representations using molecular fingerprints and graph-based features.

📊 Data Analytics & Visualization

Comprehensive data analytics projects featuring exploratory data analysis, statistical modeling, and interactive visualizations on real-world datasets.

🔮 CrystalMind — XRD Classification

Deep learning pipeline for crystal system classification from X-ray diffraction patterns using CNN, ResNet, and 1D Transformer architectures.


 Education

🏛️ Indian Institute of Technology Guwahati
📜 Master of Science (M.Sc.) in Chemistry
🔬 Focus: Computational Chemistry · Machine Learning · Materials Informatics


 Let's Connect

Open to research collaborations, PhD opportunities, and exciting projects at the intersection of chemistry and AI.

LinkedIn   Email   Portfolio   GitHub


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  1. MLChemistry MLChemistry Public

    prediction of different molecular property (HOMO-LUMO interaction gap,Dipole Moment ,polarisibility,Solubility)by allpying different ML algorithmn

    Python 3

  2. ERW_Reactive_Transport_Model ERW_Reactive_Transport_Model Public

    PHREEQC geochemical modeling of Enhanced Rock Weathering in Darjeeling tea plantations for carbon removal quantification and agricultural soil enhancement

    Python 2

  3. Molecular-Geometry-Analysis Molecular-Geometry-Analysis Public

    Molecular-Geometry-Analysis.py

  4. Study-of-Cis-Trans-Photoisomerization-in-Stilbene Study-of-Cis-Trans-Photoisomerization-in-Stilbene Public

    Study of Cis-Trans Photoisomerization in Stilbene and Ground state optimization of stilbene using different Theory.

    DIGITAL Command Language

  5. RDKit-descriptors-for-HOMO-LUMO-energy-gap-prediction RDKit-descriptors-for-HOMO-LUMO-energy-gap-prediction Public

    Forked from gashawmg/RDKit-descriptors-for-HOMO-LUMO-energy-gap-prediction

    Jupyter Notebook

  6. CrystalMind CrystalMind Public

    Python 1