kiharalab / DistPepFoldLinks
Public version for DistPepFold
☆10Updated 6 months ago
Alternatives and similar repositories for DistPepFold
Users that are interested in DistPepFold are comparing it to the libraries listed below
Sorting:
- DiffDock implementation that adds support for HPC execution using Slurm and Singularity☆26Updated 8 months ago
- Official Implementation of CompassDock☆21Updated last year
- Benchmarking active learning protocols for ligand binding affinity prediction☆13Updated 2 years ago
- ☆13Updated last year
- ProteinDesign with RFdiffusion and ProteinMPNN/LigandMPNN☆22Updated 11 months ago
- DeepSP is an antibody-specific surrogate CNN model that can generate 30 spatial properties of an antibody solely based on their sequences…☆19Updated 6 months ago
- Code for ApoDock☆21Updated 10 months ago
- Repository of all EJP lab computational projects☆15Updated 2 months ago
- Interface-aware molecular generative framework for protein-protein interaction modulators☆18Updated last year
- Automatic extraction of interacting compound-target pairs from ChEMBL.☆21Updated 4 months ago
- Clustering of SES virtual probes for pocket generation and ranking via Isolation Forest☆14Updated 2 years ago
- A PyMOL plugin with accompanying Docker image for kinase inhibitor binding and affinity prediction☆12Updated last year
- Quantitative Estimate Index for Early-Stage Screening of Compounds Targeting Protein-Protein Interactions☆18Updated 2 years ago
- Python rich client for visual protein Sequence to Structure Analysis☆18Updated 3 months ago
- Extract the PAE & pLDDT value of Alphafold2 from .pkl to .png, .csv & .pdb file.☆22Updated 4 years ago
- MEGADOCK on Google Colaboratory☆20Updated 2 years ago
- The official open-source repository for AutoMolDesigner, an easy-to-use Python application dedicated to automated molecular design.☆30Updated last year
- Python package wrapping the DOCK Fortran program and providing several tools built on top of it.☆15Updated 3 weeks ago
- Binding pocket optimization based on force fields and docking scoring functions☆37Updated 10 months ago
- ☆13Updated 2 years ago
- AI/ML Based QSAR Modeling and Translation to Deployable QSAR WebApps☆20Updated 3 months ago
- DSDPFlex: Flexible-Receptor Docking with GPU Acceleration☆23Updated last month
- De novo molecular design with deep molecular generative models for protein-protein interaction(PPI) inhibitors☆21Updated last year
- Automatically exported from code.google.com/p/pyplif☆10Updated 7 years ago
- Python code to run Supervised Molecular Dynamics (SuMD) simulations☆16Updated last year
- ☆27Updated 6 months ago
- Code for peptide ligand design with machine learning models.☆30Updated last year
- ☆12Updated last year
- scripts to find PBD structures for cancer driver proteins☆31Updated 3 weeks ago
- development repository for PyInteraph2☆22Updated 10 months ago