Good evening to everyone. I've an issue regarding a membrane simulation. I've downloaded an already equilibrated POPE/POPG membrane and, to test the system, I run an em, a 0.1 ns nvt and 1 ns npt simulation and everything was fine.
Then, I've raised the cell lenght in the z direction and added a peptide, solvate, ionized and minimized. The next ntv step was also fine but, when I run the npt simulation, suddenly the cell broadens in xy directions and shrinks in z direction. What can be wrong with it? My npt.mpd file is attached. Thanks for your help! Marco FRANZOI PhD Student University of Padua Department of biology, V floor South Tel: 3405086908 Mail: marco.franzo...@gmail.com
-- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.