Hi,
I'm not really intersected in the information that the Pulling COM option provides. I am really just interested in getting my protein move in a specific direction until it completes a full circle. To be more specific my system is F1 ATPase and I just want to pull the gamma subunit until it it completes a full circle. I am completely aware that there is an "enforced rotation" option on GROMACS but this is a torque force, which I don't want to use. ________________________________ From: gromacs.org_gmx-users-boun...@maillist.sys.kth.se <gromacs.org_gmx-users-boun...@maillist.sys.kth.se> on behalf of Nikhil Maroli <scinik...@gmail.com> Sent: June 13, 2017 1:03:03 PM To: gromacs.org_gmx-users@maillist.sys.kth.se Subject: Re: [gmx-users] Pulling COM option Hi, Out of curiosity, i wanted to ask you what information you will get by rotating protein by 360 degrees.? -- 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. -- 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.
