[AMBER] ff15ipq and divalent ions

From: Neha Gandhi <n.gandhiau.gmail.com>
Date: Tue, 13 Feb 2018 16:05:15 +1000

Dear List,

By default, leaprc.water.spceb doesn't include parameters for divalent
ions. I was wondering if the divalent ions (loadAmberParams
frcmod.ions234lm_126_spce) are compatible with amber ff15ipq protein
force-field and spce(b) model?

Thanks,
Neha
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Received on Mon Feb 12 2018 - 22:30:02 PST