Computational Chemist at FACCTs GmbH
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CompoundScripts
CompoundScripts PublicForked from ORCAQuantumChemistry/CompoundScripts
Collection of 'compound scripts' for use with the ORCA quantum chemistry software
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orca-external-tools-mabu
orca-external-tools-mabu PublicForked from faccts/orca-external-tools
This repository contains wrapper scripts compatible with the otool_external interface in ORCA.
Python
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