nianhant's Stars
ulissigroup/vasp-interactive
medford-group/catmap
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
SPARC-X/SPARC
Simulation Package for Ab-initio Real-space Calculations
HIPS/molecule-autoencoder
A project to enable optimization of molecules by transforming them to and from a continuous representation.