polypharm
importedtherapeutics/polypharm
A Python-based library to perform IFD and MM/GBSA calculations on different targets using a polypharmacological approach.
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- MIT(osi)
- Status
- dormant
- Maturity
- deployed
- Organization
- ucm-lbqc
- Country
- unknown
- Homepage
- polypharm.rtfd.io
- Repository
- github.com/ucm-lbqc/polypharm
- Documentation
- unknown
- Tags
- computational-chemistry · free-energy-calculations · molecular-docking · polypharmacology
- 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.
- biosimspacecomputational-chemistry · free-energy-calculations
An interoperable Python framework for biomolecular simulation.
- bachelor-thesiscomputational-chemistry · molecular-docking
LaTeX Bachelor's Thesis
- Bentocomputational-chemistry · molecular-docking
UV-first benchmark for protein-ligand docking with reproducible annotation, pocket similarity, and HPC workflows.
- DockM8computational-chemistry · molecular-docking
All in one Structure-Based Virtual Screening workflow based on the concept of consensus docking.
- FlowDockcomputational-chemistry · molecular-docking
A geometric flow matching model for generative protein-ligand docking and affinity prediction. (ISMB 2025)
- PoseBenchcomputational-chemistry · molecular-docking
Comprehensive benchmarking of protein-ligand structure prediction methods. (Nature Machine Intelligence)
- api.github.com/repos/ucm-lbqc/polypharmretrieved 2026-08-05 · via github-api
Machine-imported from GitHub search. Last push 2024-05-06, 3 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/55.json→ .entries["polypharm"]
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