[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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