[gmx-users] pH simulation

rajat desikan rajatdesikan at gmail.com
Thu Jun 12 11:27:25 CEST 2014


Hi,
http://www.gromacs.org/Documentation/How-tos/Constant_pH_Simulation

Gromacs users list:
http://comments.gmane.org/gmane.science.biology.gromacs.user/40950
https://www.mail-archive.com/gmx-users@gromacs.org/msg05430.html



On Thu, Jun 12, 2014 at 2:44 PM, Lovika Moudgil <lovikamoudgil at gmail.com>
wrote:

> Hi everyone...
>
> I want to do pH simulation in gromacs . I didn't found any specific link
> that I can follow for calculation regarding pH . Can you please guide me
> ..Any link that can help me...
>
>
> Thanks in advance
>
> Regards
> Lovika
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-- 
Rajat Desikan (Ph.D Scholar)
Prof. K. Ganapathy Ayappa's Lab (no 13),
Dept. of Chemical Engineering,
Indian Institute of Science, Bangalore


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