compounds

User-friendly extensions of the DrugBank database

🧪 A comprehensive chemistry library for Python.

SymSpellCompound: compound aware automatic spelling correction

Compound splitter for German language ("Komposita-Zerlegung") based on large dictionary combined with highly efficient multi-pattern string search

A database that compiles tons of information about elements and compounds.

Syntax and implementation the new C/C++iteration related compound statement group loop()

Reproducible exploration of organic photovoltaic morphology self-assembly using molecular dynamics.

Search across publicly available datasets to find instances where a drug or cell line of interest has been profiled.

Converting DrugCentral data to Rephetio identifiers

A web application to track the kinase research done by the SGC.

Get atoms from a molucular formula

A GUI to predict and draw molecular shapes using VSEPR theory (Class XI AISSCE Project)

Browser plugin that can find, highlight and link to interesting life science things in web pages and PDFs.

MDRIPred: Predicting Inhibitors Against Drug-Tolerant Mycobacterium tuberculosis

in silico medicinal chemistry.

A python package for mapping compounds via UniChem

Link compounds to protein targets, rank bioactivity (IC50/Ki/EC50), and look up drug mechanisms and indications over ChEMBL via MCP. STDIO or Streamable HTTP.

Compound UX Twig components with registry-aligned markup and role CSS

Interactively visualizing results from multi-dimensional data sets of chemical assay screening