5 projects
coremof-tools
Python API for CoRE MOF DB
sesami
Characterization Tools for Porous Materials Using Nitrogen/Argon Adsorption
tobacco-mof
Topologically Based Crystal Constructor (ToBaCCo)
mofclassifier
A Machine Learning Approach for Validating Computation-Ready Metal-Organic Frameworks
PACMAN-charge
Partial Atomic Charges for Porous Materials based on Graph Convolutional Neural Network (PACMAN)