[gmx-users] DFLEXIBLE parameter

hhhh huan scottiehuan at yahoo.com
Fri Oct 31 04:51:12 CET 2008


Dear all gmx users and developers, 

Parameter -DFLEXIBLE in mdp file will include flexible water in stead of rigid water into the topology. 
 So, will it affect the MD simulation if I include this parameter in the MD simulation? because it is unnecessary in the run parameter.

Any comments and suggestions will be well appreciated. 


      



More information about the gromacs.org_gmx-users mailing list