Suryanarayanan-Balaji / GPT-MolBERTa
☆12Updated last year
Alternatives and similar repositories for GPT-MolBERTa:
Users that are interested in GPT-MolBERTa are comparing it to the libraries listed below
- ☆15Updated last month
- ☆9Updated last year
- ☆24Updated 8 months ago
- ☆12Updated last year
- ☆11Updated 8 months ago
- Molecular Hypergraph Neural Network☆32Updated 6 months ago
- a method for CPI and DTA prediction☆9Updated 2 years ago
- ☆12Updated 2 years ago
- Structure-based drug design based on Retrieval Augmented Generation☆15Updated 3 months ago
- Quantitative Estimate Index for Early-Stage Screening of Compounds Targeting Protein-Protein Interactions☆18Updated last year
- Molecule Optimization via Fragment-based Generative Models☆40Updated last year
- ☆18Updated 3 months ago
- Improved Scaffold Hopping in Ligand-based Virtual Screening Using Neural Representation Learning☆21Updated 3 years ago
- ☆17Updated last year
- My (small) research project in solubility of drug-like molecules☆18Updated 4 years ago
- ☆13Updated 2 years ago
- [Bioinformatics 2022] Cross-Modality and Self-Supervised Protein Embedding for Compound-Protein Affinity and Contact Prediction☆13Updated 7 months ago
- DeepCDA☆13Updated 4 years ago
- Synthetic Accessible Prediction of Organic Compounds based on Graph Attention Mechanism☆20Updated last year
- COMA: Efficient Structure-constrained Molecular Generation using Contractive and Margin losses☆18Updated last year
- MMGX: Multiple Molecular Graph eXplainable Discovery☆16Updated 9 months ago
- ☆44Updated 4 years ago
- coming soon☆28Updated last year
- A deep learning framework for predicting interactions between protein-protein interaction targets and modulators☆11Updated last year
- A unified framework for predicting drug-target interactions, binding affinities and activation/inhibition mechanisms.☆11Updated 2 weeks ago
- ☆28Updated 9 months ago
- ☆15Updated 4 years ago
- ☆14Updated last year
- ☆13Updated 2 years ago
- HamidHadipour / Deep-clustering-of-small-molecules-at-large-scale-via-variational-autoencoder-embedding-and-K-means☆15Updated 10 months ago