Dear Amber users，
Could anyone tell me how to neutrolize the peptide in leap.
By default, leap adds charges to terminals and some sidechains. But I need neutralized peptide and force field parameters for each atom.
Can anyone give any help?
Best regards,
Ye Mei
ymei.itcc.nju.edu.cn
2004-10-27
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Received on Wed Oct 27 2004 - 03:53:00 PDT
