[gmx-users] How to calculate the center of the mass in gromacs

Is there the simple method to calculate the center of the mass for a group of atoms? I want to post-process the traj date file. Thanks a lot. -- gmx-users mailing listgmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at

Re: [gmx-users] How to calculate the center of the mass in gromacs

On 5/15/12 11:35 AM, xu zhijun wrote: Is there the simple method to calculate the center of the mass for a group of atoms? I want to post-process the traj date file. This is a function of g_traj. -Justin -- Justin A. Lemkul, Ph.D. Department of

Re: [gmx-users] How to calculate the center of the mass in gromacs

Thanks a lot, Justin. It works well. Jerry --- On Tue, 5/15/12, Justin A. Lemkul jalem...@vt.edu wrote: From: Justin A. Lemkul jalem...@vt.edu Subject: Re: [gmx-users] How to calculate the center of the mass in gromacs To: Discussion list for GROMACS users gmx-users@gromacs.org Date: Tuesday,