vsomnath / holoprotLinks
Multi-Scale Representation Learning on Proteins (NeurIPS 2021)
☆46Updated 2 years ago
Alternatives and similar repositories for holoprot
Users that are interested in holoprot are comparing it to the libraries listed below
Sorting:
- Intrinsic-Extrinsic Convolution and Pooling for Learning on 3D Protein Structures☆48Updated 3 years ago
- Geometry Deep Learning for Drug Discovery and Life Science☆70Updated last year
- Learning to design protein-protein interactions with enhanced generalization (ICLR 2024)☆45Updated 6 months ago
- Rotamer Density Estimator is an Unsupervised Learner of the Effect of Mutations on Protein-Protein Interaction (ICLR 2023)☆58Updated last year
- Interpretable AI pipeline improving binding predictions for novel protein targets and ligands☆39Updated last year
- ☆91Updated 9 months ago
- ☆44Updated last year
- Sequence-Structure-Surface Model for Protein Fitness Prediction (S3F)☆40Updated 7 months ago
- ☆39Updated last year
- ☆106Updated 2 years ago
- Reaction-Conditioned Virtual Screening of Enzymes☆35Updated last month
- Diffusion model based protein-ligand flexible docking method☆106Updated 8 months ago
- Pose checks for 3D Structure-based Drug Design methods☆84Updated 8 months ago
- Kinase–drug binding prediction with calibrated uncertainty quantification☆23Updated last year
- Antibody-Antigen Docking and Affinity Benchmark☆72Updated 4 years ago
- GeoSSL: Molecular Geometry Pretraining with SE(3)-Invariant Denoising Distance Matching, ICLR'23 (https://openreview.net/forum?id=CjTHVo1…☆46Updated last year
- ☆78Updated last year
- Predicting mutational effects on protein-protein binding via a side-chain diffusion probabilistic model (NeurIPS 2023 Poster)☆36Updated last year
- Fragment-based Molecular Expansion☆20Updated last year
- Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"☆68Updated last year
- generative model for drug discovery☆59Updated last year
- Database of Interacting Protein Structures (DIPS)☆102Updated last year
- ☆31Updated last year
- ☆49Updated last year
- ☆64Updated last month
- ☆20Updated 2 years ago
- Multimodal Pretraining for Unsupervised Protein Representation Learning☆22Updated 11 months ago
- Pytorch implementation for ICML 2024 paper Proteus: Exploring Protein Structure Generation for Enhanced Designability and Efficiency.☆78Updated last year
- ☆21Updated 3 years ago
- ☆83Updated last year