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De Novo Chem

AI/ML Applications for Chemistry

United States of America
https://www.denovochem.com
contact@denovochem.com

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rdchiral_plus rdchiral_plus Public

Forked from connorcoley/rdchiral

Wrapper for RDKit's RunReactants to improve stereochemistry handling. Forked from rdchiral and modified for improved speed and more robust behavior.

Python
cholla_chem cholla_chem Public

Performant, comprehensive, and customizable name-to-SMILES conversion

Python

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Showing 7 of 7 repositories

rdchiral_plus Public Forked from connorcoley/rdchiral
Wrapper for RDKit's RunReactants to improve stereochemistry handling. Forked from rdchiral and modified for improved speed and more robust behavior.

denovochem/rdchiral_plus’s past year of commit activity

Python 0 MIT 58 0 1 Updated Mar 25, 2026
cholla_chem Public
Performant, comprehensive, and customizable name-to-SMILES conversion

denovochem/cholla_chem’s past year of commit activity

Python 0 MIT 0 0 0 Updated Mar 20, 2026
agave_chem Public
Reaction classifying and atom mapping

denovochem/agave_chem’s past year of commit activity

Python 0 MIT 0 0 0 Updated Mar 18, 2026
PubChemPy Public Forked from mcs07/PubChemPy
Python wrapper for the PubChem PUG REST API.

denovochem/PubChemPy’s past year of commit activity

Python 0 MIT 123 0 0 Updated Feb 8, 2026
aizynthfinder Public Forked from MolecularAI/aizynthfinder
A tool for retrosynthetic planning

denovochem/aizynthfinder’s past year of commit activity

Python 0 MIT 176 0 0 Updated Dec 9, 2025
py2opsin Public Forked from JacksonBurns/py2opsin
Simple Python interface to OPSIN: Open Parser for Systematic IUPAC nomenclature

denovochem/py2opsin’s past year of commit activity

Python 0 MIT 6 0 0 Updated Mar 18, 2025
sonorachem_api_wrapper Public

denovochem/sonorachem_api_wrapper’s past year of commit activity

Python 0 0 0 0 Updated Feb 26, 2025

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