hoon-ock / CatBERTa
Large Language Model for Catalyst Property Prediction
☆21Updated 8 months ago
Related projects ⓘ
Alternatives and complementary repositories for CatBERTa
- ☆20Updated 5 months ago
- ☆24Updated 3 months ago
- a curated list of resources for everyone interested in learning about digital chemistry☆20Updated 2 weeks ago
- ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data☆73Updated 2 months ago
- Text-based modeling of materials.☆25Updated last week
- Predicting molecular structure from Infrared (IR) Spectra☆13Updated 5 months ago
- Language-interfaced fine-tuning for chemistry☆31Updated 11 months ago
- ChatGPT Chemistry Assistant☆72Updated last year
- ☆10Updated last month
- Unified machine learning model for predicting polymer properties through human language instructions☆13Updated 9 months ago
- Fun with P🙂s strings - canonicalize, randomize, dimerize, fingerprint☆26Updated 2 months ago
- A public repository collecting links to state of the art QA and evaluation sets for various ML and LLM applications☆76Updated 3 months ago
- Software for the text mining of the synthesis method, solvent, topology, organic linker, and metal precursor of metal-organic frameworks.☆18Updated 2 years ago
- ☆24Updated this week
- Tutorial on LLMs and agents☆14Updated 4 months ago
- Simple User-Friendly Reaction Format☆14Updated 2 weeks ago
- Simple Python interface to OPSIN: Open Parser for Systematic IUPAC nomenclature☆43Updated 3 weeks ago
- Predict and Inverse design for metal-organic framework with large-language models (llms)☆63Updated 4 months ago
- [ArXiv 2024] Generalizing Denoising to Non-Equilibrium Structures Improves Equivariant Force Fields☆21Updated 3 months ago
- ☆36Updated 2 years ago
- ☆13Updated 3 months ago
- A web app and Python API for multi-modal RAG framework to ground LLMs on high-fidelity materials informatics. An agentic materials scient…☆64Updated 3 weeks ago
- Tool for the canonicalization of Polymer SMILES (P🙂) strings☆19Updated 2 months ago
- A repository for implementing graph network models based on atomic structures.☆62Updated 3 months ago
- A Large Language Model of the CIF format for Crystal Structure Generation☆53Updated last month
- rule-based virtual polymer library generator☆25Updated last month
- ☆19Updated 3 months ago
- ☆45Updated 3 months ago
- A repository for the LLM-Prop implementation☆29Updated 6 months ago
- ☆16Updated 3 months ago