The-Institute-for-AI-Molecular-Design / ODesign-pipelineLinks
design pipeline for protein, nucleic acid, and small molecule
☆30Updated this week
Alternatives and similar repositories for ODesign-pipeline
Users that are interested in ODesign-pipeline are comparing it to the libraries listed below
Sorting:
- ☆27Updated last year
- PoseX: A Molecular Docking Benchmark☆62Updated 6 months ago
- Reaction-Conditioned Virtual Screening of Enzymes☆41Updated 7 months ago
- Evaluating Protein Binding Interfaces with Transformer Networks☆47Updated 2 years ago
- my own studied materials and scripts☆58Updated last week
- Highly accurate and efficient deep learning paradigm for full-atom protein loop modeling with KarmaLoop☆15Updated last year
- Comprehensive Benchmark for Protein-Peptide Complex Structure Prediction with AlphaFold3☆18Updated 4 months ago
- ☆77Updated 11 months ago
- ☆82Updated 2 years ago
- ☆89Updated 3 weeks ago
- Official implementation of CP-Composer. It is the released code of 《Zero-Shot Cyclic Peptide Design via Composable Geometric Constraints》…☆21Updated 5 months ago
- 📈 Fusion of sequence, structure and feature information to improve protein solubility prediction (IEEE BIBM 2024).☆25Updated 8 months ago
- Physics-Guided All-Atom Diffusion Model for Accurate Protein-Ligand Complex Prediction☆84Updated 3 months ago
- Token-Mol 1.0：tokenized drug design with large language model☆61Updated last month
- ☆39Updated last year
- Official repository of GENzyme☆60Updated last year
- Sequence-Structure-Surface Model for Protein Fitness Prediction (S3F)☆47Updated last year
- ☆35Updated 10 months ago
- Implementation of PocketXMol, the pocket-interacting molecular generative foundation model.☆104Updated 3 weeks ago
- A Multi-modal System for Automated Mining of Protein-Ligand Bioactivity Data from Literature☆68Updated 2 weeks ago
- ☆60Updated 2 years ago
- Code for humanization of antibody and nanobody☆70Updated 4 months ago
- ☆39Updated last year
- A Score-Only Adaptation of AlphaFold3 for Biomolecular Structure Evaluation☆102Updated this week
- SurfGen: Learning on Topological Surface and Geometric Structure for 3D Molecular Generation☆70Updated last year
- Knowledge-Guided Diffusion Model for 3D Ligand-Pharmacophore Mapping☆46Updated 7 months ago
- Official implementation of Generative Diffusion Models for Antibody Design, Docking, and Optimization.☆60Updated 2 years ago
- ☆40Updated 7 months ago
- Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance☆35Updated 2 years ago
- ☆59Updated 2 months ago