Re: namd development mailing list?

From: Victor Ovchinnikov (ovchinnv_at_mit.edu)
Date: Tue Jul 20 2010 - 15:00:52 CDT

Nicholas,
I do not know how to modify velocities directly. However, there is an
alternative approach in the literature which could solve your underlying
problem; it appears to require restraining potentials only; here is the
link to PubMed:

http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2846710/

Regards,
Victor

On Tue, 2010-07-20 at 13:09 -0400, Nicholas Musolino wrote:
> Dear NAMD-L:
>
> Is there a mailing list for questions related to NAMD development?
>
> The reason I am asking is because I wanted to follow up on a question I asked in April, but rather than simply re-asking on NAMD-L, I thought I could direct the question in a more appropriate direction.
>
> The subject was how to modify velocities within a global master, and I would point out that another user/developer expressed interest in the question. See links below:
> http://www.ks.uiuc.edu/Research/namd/mailing_list/namd-l/12027.html
> http://www.ks.uiuc.edu/Research/namd/mailing_list/namd-l/12045.html
>
> Thanks for any help that anyone can offer, and best regards,
> Nicholas Musolino
>
> ---------------------------------------------------------------------------
> Nicholas Musolino
> Ph.D. candidate, Department of Chemical Engineering, MIT
>
>
>

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