urban233 / PySSA
Python rich client for visual protein Sequence to Structure Analysis
☆14Updated last month
Alternatives and similar repositories for PySSA
Users that are interested in PySSA are comparing it to the libraries listed below
Sorting:
- ☆11Updated 5 months ago
- Clustering of SES virtual probes for pocket generation and ranking via Isolation Forest☆12Updated 2 years ago
- ☆13Updated last year
- Code for ApoDock☆20Updated last month
- GUI for interactive graph-based analyses of hydrogen bond networks in crystal structures and MD trajectories.☆9Updated 2 years ago
- ☆12Updated last year
- Binding pocket optimization based on force fields and docking scoring functions☆32Updated last month
- scripts to find PBD structures for cancer driver proteins☆31Updated 2 months ago
- Pocket to Concavity is a tool for refinement of Protein-Ligand binding site shape from alpha-spheres☆16Updated 7 months ago
- ☆21Updated 3 months ago
- ☆42Updated last week
- InteractionDrawer is a JavaScript library for the drawing of highly interactive 2D ligand interaction diagrams.☆20Updated last year
- A repository of the analysis and simulation tools for biomolecular modeling, simulations and drug discovery☆12Updated 2 months ago
- ☆16Updated 5 months ago
- DiffDock implementation that adds support for HPC execution using Slurm and Singularity☆25Updated 2 weeks ago
- Modelling protein conformational landscape with Alphafold☆48Updated this week
- A Motif Hash Based Method for Matching Crosslinkers into Peptides and Proteins☆18Updated last year
- PROTACable is an end-to-end in-silico design toolkit for novel PROTACs☆29Updated 11 months ago
- ☆33Updated 6 months ago
- A Python framework for the rapid modeling of glycans☆15Updated 3 months ago
- Lightweight induced fit docking☆21Updated last year
- DSDPFlex: Flexible-Receptor Docking with GPU Acceleration☆23Updated 5 months ago
- few-shot compound activity regression☆13Updated 8 months ago
- Code for the paper "Learning to engineer protein flexibility".☆17Updated last month
- This is the first model that can simultaneously predict the RMSD of the ligand docking pose and the binding strength against the target.☆18Updated 4 months ago
- ☆20Updated 7 months ago
- ☆32Updated last year
- EViS: an Enhanced Virtual Screening Approach based on Pocket Ligand Similarity☆14Updated 3 years ago
- Pretrained METL models with minimal dependencies☆14Updated 2 weeks ago
- DeepSP is an antibody-specific surrogate CNN model that can generate 30 spatial properties of an antibody solely based on their sequences…☆11Updated 4 months ago