Alternatives and similar repositories for Material-Knowledge-Graph

Users that are interested in Material-Knowledge-Graph are comparing it to the libraries listed below

• lamalab-org / MatText
  Text-based modeling of materials.
  ☆32Updated 6 months ago
• AI4ChemS / Eunomia
  Chemist AI Agent for Developing Materials Datasets with Natural Language Prompts
  ☆50Updated 6 months ago
• vertaix / LLM-Prop
  A repository for the LLM-Prop implementation
  ☆36Updated last year
• atomicarchitects / DeNS
  [TMLR 2024] Generalizing Denoising to Non-Equilibrium Structures Improves Equivariant Force Fields
  ☆35Updated 3 months ago
• sibasmarak / SymmCD
  ☆16Updated 2 weeks ago
• Fung-Lab / StructRepGen
  Atomic Structure Generation from Reconstructing Structural Fingerprints
  ☆15Updated 2 years ago
• lamalab-org / chembench-paper
  ☆21Updated 4 months ago
• ZonglinY / MOOSE-Chem
  [ICLR 2025] <MOOSE-Chem: Large Language Models for Rediscovering Unseen Chemistry Scientific Hypotheses>
  ☆42Updated this week
• microsoft / MOFDiff
  Coarse-grained Diffusion for Metal-Organic Framework Design
  ☆42Updated 11 months ago
• AdeeshKolluru / AdsorbDiff
  [ICML'24] Adsorbate Placement via Conditional Denoising Diffusion
  ☆18Updated last year
• hkqiu / Unified_ML4Polymers
  Unified machine learning model for predicting polymer properties through human language instructions
  ☆16Updated last month
• usnistgov / chemnlp
  ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data
  ☆75Updated 9 months ago
• hoon-ock / CatBERTa
  Large Language Model for Catalyst Property Prediction
  ☆25Updated last year
• webbtheosim / poly-topoGNN-vae
  ☆16Updated last year
• zhenpengyao / Supramolecular_VAE
  ☆32Updated 4 years ago
• lamm-mit / MoleculeDiffusionTransformer
  Molecular generation using diffusion models and autoregressive transformer models
  ☆11Updated last year
• olsenlabmit / Polymer-Graph-Similarity
  Quantifying Pairwise Chemical Similarity for Polymers
  ☆13Updated last year
• rxn4chemistry / rxn-ir-to-structure
  Predicting molecular structure from Infrared (IR) Spectra
  ☆19Updated last year
• lamalab-org / matextract-book
  ☆39Updated 2 months ago
• deepprinciple / react-ot
  React-OT is a generative transition state search model developed by DeepPrinciple, which uses Optimal Transport (OT) methods to generate …
  ☆15Updated 3 months ago
• vertaix / LLM4Mat-Bench
  Code and data used to create and evaluate LLM4Mat-Bench
  ☆16Updated 7 months ago
• Ramprasad-Group / polymer_information_extraction
  ☆23Updated 9 months ago
• AC-BO-Hackathon / ac-bo-hackathon.github.io
  ☆10Updated last week
• facebookresearch / crystal-text-llm
  Large language models to generate stable crystals.
  ☆103Updated 11 months ago
• facebookresearch / JMP
  Code for “From Molecules to Materials Pre-training Large Generalizable Models for Atomic Property Prediction”.
  ☆56Updated 7 months ago
• materials-data-facility / matchem-llm
  A public repository collecting links to state of the art QA and evaluation sets for various ML and LLM applications
  ☆94Updated 10 months ago
• xnuohz / DimeNet-dgl
  A DGL implementation of "Directional Message Passing for Molecular Graphs" (ICLR 2020).
  ☆20Updated last year
• pnnl / chemreasoner
  ChemReasoner - Catalyst Discovery via Large Language Model-driven Reasoning
  ☆49Updated 2 weeks ago
• TUM-DAML / gemnet_tf
  GemNet model in TensorFlow, as proposed in "GemNet: Universal Directional Graph Neural Networks for Molecules" (NeurIPS 2021)
  ☆26Updated 2 years ago
• Yeonghun1675 / ChatMOF
  Predict and Inverse design for metal-organic framework with large-language models (llms)
  ☆81Updated 3 weeks ago