[gmx-users] Changing Dielectric constant
Marc Baaden
baaden at smplinux.de
Fri Mar 5 14:10:02 CET 2004
Hi,
you can modify the dielectric constant by using a user tabulated
interaction function, mdrun option -table. Check the manual and
the mailing list archives for more details.
Marc
>>> Gaurav Porwal said:
>> Dear Gromacs users,
>>
>> How can I change the dielectric constant of the medium in which I'm
>> carrying out the simulations. I can't see any option about this in the mdp
>> file.
>>
>> Thanks in advance.
>>
>> Regards,
>> Gaurav
--
Dr. Marc Baaden - Institut de Biologie Physico-Chimique, Paris
mailto:baaden at smplinux.de - http://www.marc-baaden.de
FAX: +49 697912 39550 - Tel: +33 15841 5176 ou +33 609 843217
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