> Hi, > > > My system had a no zero total charge: > System has non-zero total charge: 6.300000e+01 > I used genion to neutralize the system by adding 6 CL ions. > > After updating the topology file, the system still seems to have the same > problem. > > It still has a non-zero total charge: > System has non-zero total charge: 5.700000e+01 >
63 non-compensated ions in the single system... I wonder what this system is.... -- Dr. Vitaly V. Chaban, 430 Hutchison Hall, Chem. Dept. Univ. Rochester, Rochester, New York 14627-0216 THE UNITED STATES OF AMERICA -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
