[gmx-users] Another solvation
David van der Spoel
spoel at xray.bmc.uu.se
Sun Jan 12 21:07:39 CET 2014
On 2014-01-12 17:50, Justin Lemkul wrote:
>
>
> On 1/12/14, 11:18 AM, behnoosh Bahadori wrote:
>>
>> Dear justin
>> I want to dissolve a ligand_protein I another solvent (not water)
>> can you help and suggest me please?
>
> http://www.gromacs.org/Documentation/How-tos/Non-Water_Solvation
>
> -Justin
>
I've just updated this page to point to my liquids server:
A series of about 150 different equilibrated liquids validated for use
with gromacs, and for the OPLS/AA and GAFF force fields, can be found at
http://virtualchemistry.org
--
David van der Spoel, Ph.D., Professor of Biology
Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone: +46184714205.
spoel at xray.bmc.uu.se http://folding.bmc.uu.se
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