Change default setting for minimization

ChemBioHTP / EnzyHTP

EnzyHTP is a python library that automates the complete life-cycle of enzyme modeling

https://enzyhtp-doc.readthedocs.io

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Open shaoqx opened 1 year ago

shaoqx commented 1 year ago

use CPU for minimization to avoid error relate to http://archive.ambermd.org/202203/0149.html