Projects in Awesome Lists by denoptim-project
A curated list of projects in awesome lists by denoptim-project .
https://github.com/denoptim-project/autocompchem
Tools for automated computational chemistry
computational-chemistry java molecular-modeling quantum-chemistry
Last synced: 11 Feb 2026
https://github.com/denoptim-project/catalyst_evaluator
Data, scripts, and software tools for automated evaluation of Ru-based catalysts for olefin metathesis.
catalysis de-novo-design molecular-descriptors molecular-design olefin-metathesis ruthenium virtual-screening
Last synced: 11 Feb 2026