ChemistryAtlas Code

bjodah/chempy

Reaction informatics and synthesisGitHubsource codechemical-formulaschemical-kineticschemical-reaction-modelchemistryphysical-chemistrypythonspeciation

⚗ A package useful for chemistry written in Python

Why it is useful: Reaction informatics and synthesis repository for chemistry, cheminformatics, molecular ML, simulation, synthesis, or drug discovery workflows.

GitHub signals: 647 stars, 83 forks, primary language: Python.

Citation: GitHub repository: bjodah/chempy

TypeCode
DomainReaction informatics and synthesis
LicenseBSD-2-Clause
Contributorsbjodah