Software

Title Sort descending Summary Software Application
SPARC SPARC is an open-source software package for the accurate, efficient, and scalable solution of the Kohn-Sham equations. Electronic Structure Calculations
SupramolecularVAE SupramolecularVAE is an open-source multi-component variational autoencoder for the property-guided inverse design of reticular frameworks including metal-organic frameworks and covalent-organic frameworks. Machine Learning
TChem v2 The TChem toolkit is a software library that enables numerical simulations using complex chemistry and facilitates the analysis of detailed kinetic models. Analytics & Other
Zeo++ Zeo++ is an open-source software for performing high-throughput geometry-based analysis of porous materials and their voids. Analytics & Other

Software

Do you see an error on the site? Please report it.