[gmx-users] (no subject)

ksr at chemistry.umass.edu ksr at chemistry.umass.edu
Tue May 10 18:12:41 CEST 2005

Hello all, 

We are trying to impliment REMD as it exists in the CVS code. We've searched 
the mailing list and have found that we are supposed to use the flag -repex 
with the mdrun command. We've searched the CVS code (downloaded today) and 
have found no instances of the string "repex" in the code. 

Could you tell us what the imput parameters are to run REMD? What do we need 
to prepare a REMD run beyond what is needed for the normal md run? 

Many thanks, 


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