> I have 403 atoms in my system. > While running the mdrun I am getting following error: > Fatal error: Max #atoms in a charge group: 403 > 32 > Any suggestion how to get rid of this?
Reduce the size of your charge groups. From that warning, appears that for your system all 403 are within the same charge group, which is larger than the current limit of 32. Catch ya, Dr. Dallas Warren Lecturer Department of Pharmaceutical Biology and Pharmacology Victorian College of Pharmacy, Monash University 381 Royal Parade, Parkville VIC 3010 [EMAIL PROTECTED] +61 3 9903 9524 --------------------------------- When the only tool you own is a hammer, every problem begins to resemble a nail. _______________________________________________ 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
