[gmx-users] Re: Increase in charge after adding the ligand

[bharat gupta]

Hi,

Initially while preparing the structure , -2 charge was there on the
protein. Next, after adding the ligand and executing grompp statement It
showing -9.9 charge. So I added 9 sodium ions. but still its showing +8
charge on the system. what shall I do in this case ??

-- 
Bharat
Ph.D. Candidate
Room No. : 7202A, 2nd Floor
Biomolecular Engineering Laboratory
Division of Chemical Engineering and Polymer Science
Pusan National University
Busan -609735
South Korea
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