pharmaceutical-research

Here are 8 public repositories matching this topic...

Elliot-Chan-120 / NOCTURNAL

NOCTURNAL: Exploring the dark chemical space. A streamlined computational drug discovery platform from target identification to optimized drug visualization. Featuring a unique molecular optimization algorithm "MutaGen" and an interactive chemical space visualization module "ChemNet". All reinforced behind a modular, fault-tolerant architecture.

data-science machine-learning bioinformatics parsing cheminformatics prediction bioinformatics-pipeline drug-discovery data-analysis network-analysis datavisualization tanimoto molecular-fingerprints molecular-optimization chemical-space-exploration bioactivity-prediction pharmaceutical-research

Updated Jan 18, 2026
Python

Thembelitchi / Target-Repurposing-Hypothesizer

Star

A GNN-based platform for predicting novel drug-target interactions to accelerate R&D.

gene-expression drug-discovery drug-repurposing pubchem signaling-pathways opentargets neo4j-graph chembl rag pytorch-geometric gnn pytorch-gnn heterogeneous-graph-transformer pharmaceutical-research string-db biogpt4 biochemical-feasibility ligand-to-protein

Updated Jun 12, 2026
TypeScript

Johnkecops / Drug_Repurposing_in_silico_pipeline

Sponsor

Star

Drug Repurposing in silico pipeline

bioinformatics bioinformatics-pipeline bioinformatics-analysis bioinformatics-scripts bioinformatics-tool pharmaceutical pharmaceutical-science pharmaceutical-research pharmaceutical-ai bioinformatics-common pharmaceutical-sciences

Updated Oct 13, 2026
Python

Flamehaven-Labs / rexsyn-experiment-sep01-artifacts

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Initial release: Upadacitinib topical formulation verification (SEP-01 to EXP-03)

bioinformatics simulation open-science drug-discovery autonomous-agents research-data medical-ai autonomous-agent pharmaceutical-research rexsyn-nexus upadacitinib

Updated Jan 28, 2026

nguyendotrungvuong-cmd / LongChau_Crawl_Demo2

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Demo2

pharmaceutical-products pharmaceuticals pharmaceutical pharmaceutical-manufacturing pharmaceutical-research pharmaceuticalcare pharmaceutical-supply

Updated Sep 12, 2026
Python

Praveen-R-328 / berberine-molecular-docking-admet

Star

Computational medicinal chemistry project integrating molecular docking, network pharmacology, and ADMET prediction to evaluate berberine as a potential therapeutic candidate against Type 2 Diabetes Mellitus.

cheminformatics computational-chemistry drug-discovery molecular-docking autodock-vina admet computer-aided-drug-design medicinal-chemistry network-pharmacology type-2-diabetes pharmaceutical-research berberine

Updated Jul 8, 2026

ncreighton / a8e79d81-pharmaceutical-research-and-cl

Star

Streamline pharmaceutical research & clinical trials with a customizable Notion template

productivity research manager templates clinical medical healthcare trial notion health-tech pharmaceutical notion-template pharmaceutical-research

Updated Aug 5, 2026

api-evangelist / xtalpi

Star

XtalPi — independent third-party profile of a public API surface, by API Evangelist. XtalPi is an AI-and-quantum-physics drug discovery and materials research platform company with headquarters in Cambridge, Massachusetts and major operations in Beijing, Shanghai, and Shenzhen, publicly listed on the Hong Kong Stock Exchange under stock code 2228.H

robotics quantum-mechanics computational-chemistry molecular-simulation drug-discovery lab-automation materials-science life-sciences biotechnology quantum-physics free-energy-perturbation apis-json peptide-therapeutics generative-chemistry ai-drug-discovery pharmaceutical-research solid-state-research intelligent-laboratories

Updated Oct 24, 2026

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