Dear gmx-users,
 
I am wondering whether or not there is a good reason to use flex_spc during 
energy minimisation and spc during production run? I guess one would not use 
flex_spc during a production run as this would decrease the time step needed 
quite a lot - but is it a good idea to use during EM as the system easier 
relaxes?
I know that strictly this is not a gromacs related issue, but if you could say 
just 'yes' or 'no', I would very much appreciate it.
 
Thank you for all your help and quick answers,
Sarah
--
gmx-users mailing list    gmx-users@gromacs.org
http://lists.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/search before posting!
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to gmx-users-requ...@gromacs.org.
Can't post? Read http://www.gromacs.org/mailing_lists/users.php

Reply via email to