pyscreener
importedtherapeutics/pyscreener
pythonic interface to virtual screening software
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- MIT(osi)
- Status
- maintained
- Maturity
- deployed
- Organization
- coleygroup
- Country
- unknown
- Homepage
- unknown
- Repository
- github.com/coleygroup/pyscreener
- Documentation
- unknown
- Tags
- computational-biology · distributed-computing · molecular-docking · ray · virtual-screening
- Regulatory
- unknown
Top contributors by commit count, from the project’s public repository. Avatars are served by their origin, not stored here. To be removed from this list, open an issue.
Computed from shared tags, weighted so a rare tag counts for more than a common one. These are suggestions, not curated relationships.
- docktgridmolecular-docking · virtual-screening
Generate customized voxel representations of protein-ligand complexes using GPU.
- FBKdockmolecular-docking · virtual-screening
FBKdock: fully automated end-to-end molecular docking pipeline (protein preparation, redocking RMSD validation, virtual screening) powered by Vina-GPU / AutoDock Vina.
- labodockmolecular-docking · virtual-screening
LABODOCK: A Colab-Based Molecular Docking Tools
- MolDockLabmolecular-docking · virtual-screening
MolDockLab is a data-driven workflow developed to identify the best balanced consensus Structure-Based Virtual Screening (SBVS) workflow for a target of interest.
- rxdockmolecular-docking · virtual-screening
RxDock is a fork of rDock. Note: the latest code is under development. Please do git checkout patched-rdock after clone if you want patched rDock. [IMPORTANT NOTE: pull requests should be posted on…
- scip-dockingfactory-bundlemolecular-docking · virtual-screening
Docking Factory is a tool to automate molecular docking runs on an HPC cluster using the Dask framework. DockingFactory provides unified way of running molecular docking with different software…
- api.github.com/repos/coleygroup/pyscreenerretrieved 2026-08-05 · via github-api
Machine-imported from GitHub search. Last push 2025-09-04, 94 stars, license reported as MIT. Category and schematic were assigned by keyword heuristics and are unreviewed.
Not yet verified by a human. Correct this record →
/v1/entries/41.json→ .entries["pyscreener"]
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