acpype
Topology generator
A tool for generating topologies for chemical compounds using Antechamber and interfacing with other applications.
OFFICIAL: AnteChamber PYthon Parser interfacE
208 stars
8 watching
49 forks
Language: Python
last commit: about 1 year ago
Linked from 1 awesome list
ambermdambertoolscharmmcnsgromacspython3topologiesxplor
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