facebookresearch / crystal-text-llmLinks
Large language models to generate stable crystals.
☆109Updated last year
Alternatives and similar repositories for crystal-text-llm
Users that are interested in crystal-text-llm are comparing it to the libraries listed below
Sorting:
- [TMLR 2024] Generalizing Denoising to Non-Equilibrium Structures Improves Equivariant Force Fields☆37Updated 5 months ago
- Code for “From Molecules to Materials Pre-training Large Generalizable Models for Atomic Property Prediction”.☆59Updated 8 months ago
- A repository for the LLM-Prop implementation☆42Updated last year
- Official code for Periodic Graph Transformers for Crystal Material Property Prediction (NeurIPS 2022)☆100Updated last year
- Transformer model for structure-agnostic metal-organic frameworks (MOF) property prediction☆52Updated last year
- Text-based modeling of materials.☆32Updated 7 months ago
- ☆46Updated 7 months ago
- How good are LLMs at chemistry?☆103Updated 2 weeks ago
- ☆58Updated 7 months ago
- Code for “FlowMM Generating Materials with Riemannian Flow Matching” and "FlowLLM: Flow Matching for Material Generation with Large Langu…☆149Updated 8 months ago
- This repository contains a collection of resources and papers on GNN Models on Crystal Solid State Materials☆98Updated last month
- Uncover meaningful structures of latent spaces learned by generative models with flows!☆42Updated last year
- [COLING 2025]A curated paper list about LLMs for chemistry☆80Updated last week
- A web app and Python API for multi-modal RAG framework to ground LLMs on high-fidelity materials informatics. An agentic materials scient…☆84Updated 9 months ago
- Official implementation of All Atom Diffusion Transformers (ICML 2025)☆242Updated last month
- ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data☆76Updated 3 weeks ago
- Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023☆122Updated last year
- ☆16Updated last month
- A public repository collecting links to state of the art QA and evaluation sets for various ML and LLM applications☆98Updated last year
- Large Language Model for Catalyst Property Prediction☆26Updated last year
- Reference implementation of "Ewald-based Long-Range Message Passing for Molecular Graphs" (ICML 2023)☆50Updated 2 years ago
- [NeurIPS 2024] Official implementation of the Efficiently Scaled Attention Interatomic Potential☆51Updated 4 months ago
- What can Large Language Models do in chemistry? A comprehensive benchmark on eight tasks☆152Updated 11 months ago
- Higher-order equivariant neural networks for charge density prediction in materials☆59Updated 4 months ago
- [TMLR 2023] Training and simulating MD with ML force fields☆112Updated 8 months ago
- ☆23Updated last year
- Predict and Inverse design for metal-organic framework with large-language models (llms)☆86Updated 2 months ago
- A Large Language Model of the CIF format for Crystal Structure Generation☆112Updated 6 months ago
- React-OT is a generative transition state search model developed by DeepPrinciple, which uses Optimal Transport (OT) methods to generate …☆21Updated 4 months ago
- ICML2024: Equivariant Graph Neural Operator for Modeling 3D Dynamics☆56Updated last year