Re: editing the code of the non bonded pair potentials

From: Victor (
Date: Fri Aug 30 2013 - 18:19:04 CDT

On 08/30/2013 07:00 PM, Gianluca Interlandi wrote:
> Hi Victor!
> Thanks for this link. I'm really curious about mindy. I have downloaded
> it. Do you know whether it supports the CHARMM CMAP correction?

Looking at the code, it does not, but that would be easy to adapt from
the NAMD's ComputeCrossterms.C; the more troublesome part is the lack of
long-range electrostatic treatments. Just a good MD toy !


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