DScribe

Description

DScribe website  

DScribe is a python package for creating machine learning descriptors for atomistic systems.

Environment Modules

Run module spider DScribe to find out what environment modules are available for this application.

System Variables

• HPC_DSCRIBE_DIR - installation directory
• HPC_DSCRIBE_BIN - executable directory

Citation

If you publish research that uses DScribe you have to cite it as follows:

DScribe: Library of descriptors for machine learning in materials science