turn on use_gauoptonly if molecule net charge not zero - Githubissues

pren / poltype

POLTYPE: AMOEBA parametrization tool

https://pren.github.io/poltype

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turn on use_gauoptonly if molecule net charge not zero #35

Closed misterbrandonwalker closed 4 years ago

misterbrandonwalker commented 4 years ago

turn on use_gauoptonly if molecule net charge not zero