[gmx-users] Hi All..one question about charge making

uki zhu ukizhu at gmail.com
Fri Aug 31 04:57:00 CEST 2007

Dear all gmx-users,
Sorry to bother you.
I am trying to make a molecule with a unit charge well-distributed. But I do
not know how to write such *.top file. Does every atom get the same charge
at the beginning? And can we use Gromacs to simulate the changes of the
charge distribution?
Any help would be appreciated!

Thank you very much!

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