Ecosyste.ms: Repos

An open API service providing repository metadata for many open source software ecosystems.

GitHub topics: joback

ClapeyronThermo/GCIdentifier.jl

tools to perform group contribution (GC) identification, given the SMILES of a compound

Language: Julia - Size: 713 KB - Last synced: about 4 hours ago - Pushed: about 1 month ago - Stars: 10 - Forks: 1

ipqa-research/ugropy

A Python library designed to swiftly and effortlessly obtain the UNIFAC groups from molecules by their names and subsequently integrate them into inputs for thermodynamic libraries.

Language: Python - Size: 3.67 MB - Last synced: 2 months ago - Pushed: 3 months ago - Stars: 6 - Forks: 1