Hi, On Tuesday, 4. September 2007 09:49, TANG JIAOWEI wrote: > Dear all, > I am beginner in Gromacs. When I used g_hbond to calculate the number > of hydrogen bonds between two proteins, "floating exception" happened. I > try it many times, and the same problem is still exsits. Could you tell me > what is the problem? > Thank you !
Please specify your problem more - size of the system, protein does other utilities work, does g_hbond work with smaller systems on your hardware? g_hbond needs huge amount of memory, perhaps you have to change your index groups to a smaller number our change your analysis computer. > > > Jiaowei Tang Greetings, Florian -- ------------------------------------------------------------------------------- Florian Haberl Computer-Chemie-Centrum Universitaet Erlangen/ Nuernberg Naegelsbachstr 25 D-91052 Erlangen Telephone: +49(0) − 9131 − 85 26581 Mailto: florian.haberl AT chemie.uni-erlangen.de ------------------------------------------------------------------------------- _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! 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
