As g_hbond says:

"* The option -sel that used to work on selected hbonds is out of order, and
 therefore not available for the time being."

/Erik

----- Original Message ----- From: "OZGE ENGIN" <[EMAIL PROTECTED]>
To: <[email protected]>
Sent: Tuesday, December 26, 2006 10:23 AM
Subject: [gmx-users] -sel option / g_hbond


Hi,

First of all, thank you very much for your earlier explanations, they helped me much. Now, I have a problem with the -sel option of g_hbond. I want to analyze the specific hydrogen bonds in my system, in this respect I created a file (.ndx), and then I called it with the -sel option. Then, I encountered the following error:

Invalid command line argument:
-sel

(I use the 3.3.1 version)

Should I take the atom numbers from the pdb file in order to represent the atoms in .ndx file ?

Thank in advance

Özge


_______________________________________________
gmx-users mailing list    [email protected]
http://www.gromacs.org/mailman/listinfo/gmx-users
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to [EMAIL PROTECTED]
Can't post? Read http://www.gromacs.org/mailing_lists/users.php

_______________________________________________
gmx-users mailing list    [email protected]
http://www.gromacs.org/mailman/listinfo/gmx-users
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to [EMAIL PROTECTED]
Can't post? Read http://www.gromacs.org/mailing_lists/users.php

Reply via email to