Dear all friends, I wonder why we should impose POSRES on the protein in the system while running NVT?! Shall we do so even for the system containing a short peptide?! What if I let the peptide, SOL+ions and my system's synthetic polymer apply T-coupling individually?
I would be greatly thankful for your helps in advance. Best Regards Arman -- View this message in context: http://gromacs.5086.n6.nabble.com/Why-Position-Restraint-on-Protein-in-NVT-tp5002196.html Sent from the GROMACS Users Forum mailing list archive at Nabble.com. -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! * Please don't post (un)subscribe requests to the list. Use the www interface or send it to [email protected]. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
