hoon-ock / CatBERTaLinks
Large Language Model for Catalyst Property Prediction
☆26Updated last year
Alternatives and similar repositories for CatBERTa
Users that are interested in CatBERTa are comparing it to the libraries listed below
Sorting:
- ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data☆76Updated 10 months ago
- A public repository collecting links to state of the art QA and evaluation sets for various ML and LLM applications☆95Updated 11 months ago
- ☆25Updated 10 months ago
- ☆40Updated 3 months ago
- ☆46Updated 2 years ago
- ☆10Updated 2 weeks ago
- Tool for the canonicalization of Polymer SMILES (P🙂) strings☆24Updated 9 months ago
- This is a conditionally generative model for crystal structures based on a modified version of CDVAE.☆31Updated 2 weeks ago
- Crystal Edge Graph Attention Neural Network☆22Updated last year
- FTCP code☆34Updated last year
- A repository for implementing graph network models based on atomic structures.☆85Updated 10 months ago
- Chemist AI Agent for Rational Inverse Design of Materials☆31Updated 3 months ago
- Text-based modeling of materials.☆32Updated 7 months ago
- ☆31Updated 3 years ago
- Predict and Inverse design for metal-organic framework with large-language models (llms)☆84Updated last month
- A repository for the LLM-Prop implementation☆39Updated last year
- Fun with P🙂s strings - canonicalize, randomize, dimerize, fingerprint☆34Updated 9 months ago
- Predicting molecular structure from Infrared (IR) Spectra☆21Updated last year
- rule-based virtual polymer library generator☆37Updated last week
- Deep learning model for predicting adsorption isotherms of MOFs☆14Updated 2 years ago
- An ecosystem for digital reticular chemistry☆48Updated 9 months ago
- ☆25Updated last year
- Unified machine learning model for predicting polymer properties through human language instructions☆17Updated last month
- Language-interfaced fine-tuning for chemistry☆42Updated last year
- train and use graph-based ML models of potential energy surfaces☆97Updated this week
- Software for the text mining of the synthesis method, solvent, topology, organic linker, and metal precursor of metal-organic frameworks.☆22Updated 3 years ago
- A trivial demo of chemical regioselectivity prediction via machine learning☆12Updated last year
- ☆16Updated last month
- Implementation of "TransPolymer: a Transformer-based language model for polymer property predictions" in PyTorch☆69Updated last year
- SLICES: An Invertible, Invariant, and String-based Crystal Representation [2023, Nature Communications] MatterGPT, SLICES-PLUS☆110Updated 3 months ago