dear users, i have modelled a system containing a protein plus a DNA and water molecules. Now I am wondering, if it is possible to use s.th. like g_energy to plot the fluctuation of energy, temperature, pressure etc. only of the protein and the DNA and NOT with the water molecules. that is because i want to compare several simulation runs and their changes in energy, temp ... .
Is there any option to do so ? I also have defined lots of index groups for distinguish between groups in the system. So I would be very happy if you have a solution for my problem, thank you very much in advance and have a nice evening. greetings joern _______________________________________________ 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
