feiglab / idpganLinks
☆51Updated last year
Alternatives and similar repositories for idpgan
Users that are interested in idpgan are comparing it to the libraries listed below
Sorting:
- code for SeqDance/ESMDance, biophysics-informed protein language models☆53Updated 2 weeks ago
- Benchmarking code accompanying the release of `bioemu`☆54Updated 2 months ago
- 🔥 PyTorch implementation of GNINA scoring function for molecular docking☆73Updated 11 months ago
- Precise Generation of Conformational Ensembles for Intrinsically Disordered Proteins with IDPFold☆26Updated last year
- Multi-target de novo molecular generator conditioned on AlphaFold's latent protein embeddings.☆73Updated 10 months ago
- A benchmark for 3D biomolecular structure prediction models☆69Updated 8 months ago
- Data sharing for High-throughput Prediction of Changes in Protein Conformational Distributions with Subsampled AlphaFold2☆43Updated last year
- Modelling protein conformational landscape with Alphafold☆54Updated 5 months ago
- Novel estimator for the change in stability upon point mutation in monomeric and multimeric proteins.☆61Updated 8 months ago
- Fast and accurate molecular docking with an AI pose scoring function☆42Updated 2 years ago
- Composing Unbalanced Flows for Flexible Docking and Relaxation (ICLR 2025)☆54Updated 7 months ago
- Fragment-based Molecular Expansion☆27Updated 2 years ago
- NodeCoder is a general framework based on graph convolutional neural network for protein function prediction.☆34Updated last year
- Boltzmann-ranked alternative protein conformations from reduced-MSA AlphaFold2☆60Updated last week
- ☆36Updated 2 months ago
- ☆32Updated last year
- 3D equivariant graph transformer for all-atom refinement of protein tertiary structures☆27Updated 2 years ago
- Convert coarse-grained protein structure to all-atom model☆50Updated 8 months ago
- ☆89Updated last year
- ☆37Updated 2 years ago
- Structure prediction of alternative protein conformations☆80Updated 11 months ago
- A surface-based deep learning approach for the prediction of ligand binding sites on proteins☆44Updated 2 years ago
- Automatic Retrieval and ClusTering of Interfaces in Complexes from 3D structural information☆32Updated 2 weeks ago
- ☆80Updated last year
- ☆47Updated 9 months ago
- A variational autoencoder that directly generates the 3D coordinates of immunoglobulin protein backbones.☆32Updated 3 years ago
- A pipeline that used ML model based on Rosetta descriptors to predict the binding affinity of protein-protein complexes☆49Updated 3 months ago
- Python package for the analysis of natural and modified peptides using a set of modules to study their sequences☆47Updated 2 months ago
- mdml: Deep Learning for Molecular Simulations☆50Updated 8 months ago
- Implementation of the Confidence Bootstrapping procedure for protein-ligand docking.☆27Updated last year