Am 04.05.20 um 21:33 schrieb Zheng Ruan:
Hi, I'm trying to setup an antiparallel membrane system for CompEL simulation. It is relatively straightforward to convert an existing single membrane system to a parallel system by using # gmx genconf -f system.gro -nbox 1 1 2 -o system.parallel.gro However, is there an easy way to invert one of the membrane protein configurations along with the membrane, water and ions?
You could try: gmx editconf -rotate 90 0 0 Cheers, Jochen
Thanks, Zheng
-- --------------------------------------------------- Prof. Dr. Jochen Hub Theoretical Biophysics Group Department of Physics, Saarland University Campus E2 6, Zi. 4.11, 66123 Saarbruecken, Germany Phone: +49 (0)681 302-2740 https://biophys.uni-saarland.de/ --------------------------------------------------- -- 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.
