Re: [gmx-users] g_hbond -contact option

2006-11-23 Thread Yang Ye
Besides used for h-bond, g_hbond can be used for determine whether the distance has fallen into a range (with -nocontact and -r and -r2). g_dist is not good for calculate for distance between two atoms but g_mindist can perform this job well. Actually, because of a compulsive input of tpr file

Re: [gmx-users] g_hbond -contact option

2006-11-22 Thread Erik Marklund
ndrea carotti" <[EMAIL PROTECTED]> To: Sent: Wednesday, November 22, 2006 10:46 AM Subject: [gmx-users] g_hbond -contact option Hi all, I have found this interesting option in g_hbond, and I would like to know something more about it. How does it work? Which is the difference with other

Re: [gmx-users] g_hbond -contact option

2006-11-22 Thread Erik Marklund
From: "andrea carotti" <[EMAIL PROTECTED]> To: Sent: Wednesday, November 22, 2006 10:46 AM Subject: [gmx-users] g_hbond -contact option Hi all, I have found this interesting option in g_hbond, and I would like to know something more about it. How does it work? Which is the difference

[gmx-users] g_hbond -contact option

2006-11-22 Thread andrea carotti
Hi all, I have found this interesting option in g_hbond, and I would like to know something more about it. How does it work? Which is the difference with other tools like g_dist? Thanks to all Andrea ___ gmx-users mailing listgmx-users@gromacs.org ht