subject:"\[gmx\-users\] select groups in g_rms"

Re: [gmx-users] select groups in g_rms

2011-12-20 Thread Gianluca Santoni

You could start by reading the gromacs manual, Section 8.9 On 12/20/11 9:30 AM, yp sun wrote: Dear Sir, When I run g_rms -s md.tpr -f md.trr -o rmsd.xvg, the program requires me selecting a group twice as following: g_rms -s md.tpr -f md.trr -o rmsd.xvg?, ??? ? ??,??: Reading file md.tpr, V

[gmx-users] select groups in g_rms

2011-12-20 Thread yp sun

Dear Sir, When I run g_rms -s md.tpr -f md.trr -o rmsd.xvg, the program requires me selecting a group twice as following: g_rms -s md.tpr -f md.trr -o rmsd.xvg后, 程序两次要求选结构组,如下: Reading file md.tpr, VERSION 3.3.1 (single precision) Reading file md.tpr, VERSION 3.3.1 (single precision) Select