[gmx-users] charge correction in prodrg
Justin Lemkul
jalemkul at vt.edu
Sun Jul 28 17:16:49 CEST 2019
On 7/28/19 11:13 AM, Andrew Bostick wrote:
> Dear Justin,
>
> Thanks for your answer. Does ATB need no correction?
You should never view any server as a black box that would never require
modification, but ATB is substantially more reliable than PRODRG. I have
seen many ATB topologies that are, however, perfectly valid.
-Justin
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Justin A. Lemkul, Ph.D.
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