The mdgx program in amber can do it for you. Still need to get the formal
tutorial up on the live website, but:
http://casegroup.rutgers.edu/~cerutti/amber_web/tutorials/advanced/tutorial28/index.php
The techniques can also be applied to generate straight REsP-like charges
(I say REsP-like because the restraints are harmonic, not hyperbolic, but
the output is hardly different as long as you have a decent amount of
fitting data).
Dave
On Tue, Jul 4, 2017 at 1:23 PM, Rana Rehan Khalid <rrkhalid.umich.edu>
wrote:
> HI everyone is there any other RED type server which can calculates charges
> kindly tell me thanks.
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Received on Tue Jul 04 2017 - 11:00:02 PDT
