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@M3RG-IITD Multiphysics and Multiscale Mechanics Research Group (M3RG), IIT Delhi

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    33 repositories

    • llamat

      Public
      Materials Science Understanding Large Language Model
      Jupyter Notebook
      •0•9•1•0•Updated Mar 28, 2025Mar 28, 2025

    • AILA

      Public
      Artificially Intelligent Laboratory Assistant
      Python
      •
      MIT License
      •0•3•0•0•Updated Mar 14, 2025Mar 14, 2025

    • Force-field-optimization

      Public
      Jupyter Notebook
      •
      MIT License
      •0•1•0•0•Updated Mar 14, 2025Mar 14, 2025

    • Complex-Neural-Operator

      Public
      Complex Neural Operator for Learning the Dynamics of Continuous Physical Systems
      Python
      •0•2•0•0•Updated Mar 11, 2025Mar 11, 2025

    • CoNO_for_CO

      Public
      This repository contains the codes for both training and evaluation of the CoNO and FNO models trained for the paper
      Python
      •0•1•0•0•Updated Mar 11, 2025Mar 11, 2025

    • MatSci-IE-Challenges

      Public
      Jupyter Notebook
      •0•1•0•0•Updated Feb 24, 2025Feb 24, 2025

    • Industry_Clinker_Mineralogy

      Public
      Industrial-scale Prediction of Cement Clinker Phases using Machine Learning
      Jupyter Notebook
      •0•0•0•0•Updated Dec 28, 2024Dec 28, 2024

    • matsciml

      Public
      Open MatSci ML Toolkit is a single framework for prototyping and scaling out deep learning models for materials discovery, built on top of OpenCatalyst, PyTorch Lightning, and the Deep Graph Library.
      Python
      •
      MIT License
      •26•0•0•0•Updated Jun 25, 2024Jun 25, 2024

    • SRIMP_Hardness

      Public
      Jupyter Notebook
      •0•2•0•0•Updated Jun 22, 2024Jun 22, 2024

    • MatSci-LLM

      Public
      0•2•0•0•Updated Jun 21, 2024Jun 21, 2024

    • cod-bench

      Public
      We present cod-bench containing 12 operators and 10 datasets.
      Python
      •1•9•0•0•Updated Jun 5, 2024Jun 5, 2024

    • MaScQA

      Public
      Jupyter Notebook
      •2•14•1•0•Updated May 10, 2024May 10, 2024

    • DiSCoMaT

      Public
      Python
      •
      Other
      •0•9•0•0•Updated Mar 6, 2024Mar 6, 2024

    • MDBENCHGNN

      Public
      Python
      •
      Other
      •0•11•4•0•Updated Nov 19, 2023Nov 19, 2023

    • StriderNET

      Public
      Striding through the energy landscape
      optimizationrlgnn
      Jupyter Notebook
      •0•2•0•0•Updated Jul 26, 2023Jul 26, 2023

    • StrainEvolution

      Public
      Python
      •
      Creative Commons Zero v1.0 Universal
      •0•2•1•0•Updated Jul 18, 2023Jul 18, 2023

    • HGNN

      Public
      Hamiltonian Graph Neural Network
      Jupyter Notebook
      •0•0•0•0•Updated Jun 30, 2023Jun 30, 2023

    • ML-Conductivity

      Public
      Jupyter Notebook
      •0•1•0•0•Updated Jun 4, 2023Jun 4, 2023

    • BroGNet

      Public
      Jupyter Notebook
      •0•1•0•0•Updated May 29, 2023May 29, 2023

    • Physics-Informed-GNNs

      Public
      # Graph Neural Networks
      MIT License
      •1•5•0•0•Updated Mar 31, 2023Mar 31, 2023

    • chgs-ai

      Public
      Jupyter Notebook
      •0•0•0•0•Updated Feb 23, 2023Feb 23, 2023

    • MatSciBERT

      Public
      Material Science Aware Language Model
      Python
      •
      GNU General Public License v3.0
      •15•96•0•1•Updated Jan 21, 2023Jan 21, 2023

    • Cementron

      Public
      Jupyter Notebook
      •0•0•0•0•Updated Dec 20, 2022Dec 20, 2022

    • benchmarking_graph

      Public
      Python
      •
      Other
      •2•11•1•0•Updated Nov 30, 2022Nov 30, 2022

    • graph_neural_ODE

      Public
      Python
      •0•0•0•0•Updated Nov 19, 2022Nov 19, 2022

    • FNO-StressStrain

      Public
      Using Fourier Neural Operator to measure the physical fields for a mode-I failure of 2D composites
      Jupyter Notebook
      •
      Other
      •0•12•0•0•Updated Nov 13, 2022Nov 13, 2022

    • rigid_body_dynamics_graph

      Public
      Jupyter Notebook
      •
      MIT License
      •5•13•0•0•Updated Oct 20, 2022Oct 20, 2022

    • ML-DOS

      Public
      Implementation of unsupervised GNN (GraphSAGE) to generate node representations for disordered systems. OPTICS clustering of obtained node embeddings reveals structure-dynamics correlation.
      Jupyter Notebook
      •0•8•0•0•Updated Jun 14, 2022Jun 14, 2022

    • PeriDyn

      Public
      Jupyter Notebook
      •0•0•0•0•Updated Jun 8, 2022Jun 8, 2022

    • LGNN

      Public
      Lagrangian Graph Neural Network
      Python
      •
      MIT License
      •3•4•0•0•Updated Apr 27, 2022Apr 27, 2022