PyRank

Organic Chemistry Python Packages

Python packages with the GitHub topic organic-chemistry. Sorted by monthly downloads, with stars and forks.
HiroYokoyama
moleditpy

MoleditPy -- A cross-platform, simple, and intuitive molecular editor built in Python. Please note that these codes are written with the assistance of LLM.

16K 7 1
HiroYokoyama
moleditpy-linux

MoleditPy -- A cross-platform, simple, and intuitive molecular editor built in Python. Please note that these codes are written with the assistance of LLM.

14K 7 1
JonasRackl
labmate-mcp

Your AI lab companion — 78 MCP tools for literature, compounds, synthesis, benchwork, peptides & publication writing

472 3 0
mrodobbe
rxn-insight

Deterministic classification, naming, and analysis of chemical reactions

395 57 18
schwallergroup
reactionclassifier

Fast, lightweight reaction classification with high granularity

234 32 1
harshil21
carbonpy

An Organic Chemistry module

76 17 0
bobbypaton
sterimol

Calculate Sterimol Parameters from Sructure Input/Output Files

31 28 8