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Pharmacology Python Packages

Python packages with the GitHub topic pharmacology. Sorted by monthly downloads, with stars and forks.
cthoyt
chembl-downloader

Write reproducible code for getting and processing ChEMBL

5K 95 15
Rockman6
cellsim

Physics-first, uncertainty-honest in-silico cell and drug-response simulator (Python). Validated docking/ADMET input layer (Vina, OpenFF, xTB), cell-level PK/PD modules, and a cell/colony engine under construction toward a validated interactive dish.

329 135 20
joelb123
rafm

Reliable AlphaFold Measures

219 2 0
bio2bel
bio2bel-drugbank

A Bio2BEL package for DrugBank (https://www.drugbank.ca)

178 10 5
agentcures
refua-preclinical

Preclinical operations toolkit for GLP tox and pharmacology planning, in vivo scheduling, and bioanalysis workflows.

144 0 0
s-rani1
pharmacoml

Benchmark-backed hybrid AI/ML covariate screening toolkit for population PK/PD, combining explainable ML, penalized confirmation, and SCM-style bridging.

107 0 0
Hezarani
dentrx

An open, guideline-cited dental prescribing reference (antibiotics & analgesics) — US + UK, adults & children. Educational reference, not a prescription.

92 0 0
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