[gmx-users] re: implicit solvent and REMD

Mu Yuguang (Dr) YGMu at ntu.edu.sg
Thu Apr 22 10:54:01 CEST 2004


Have anyone try the REMD method with explicit water model?


-----Original Message-----
From: gmx-users-admin at gromacs.org [mailto:gmx-users-admin at gromacs.org]
On Behalf Of Walter Ash
Sent: Wednesday, April 21, 2004 10:56 PM
To: gmx-users at gromacs.org
Subject: [gmx-users] re: implicit solvent and REMD

REMD:
http://moose.bio.ucalgary.ca/People/Walter/Software/remd-gmx314.tgz

Unfortunately I haven't yet moved it to 3.2.x - that's next on the
agenda, as well as some cosmetic changes.

> Message: 8
> Date: Tue, 20 Apr 2004 15:27:12 -0400
> To: gmx-users at gromacs.org
> From: Bamidele Adisa <badisa at CLEMSON.EDU>
> Subject: [gmx-users] implicit solvent and REMD
> Reply-To: gmx-users at gromacs.org
> 
> Hi,
> I'd like to know if anyone out there has successfully implemented an 
> implicit solvent model in Gromacs
> as well as replica exchange md (REMD) in Gromacs. I'm very much
interested 
> in using these methods for my work.
> could anyone offer any suggestions?
> thanks
> dele


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