Hello,
I have a simple and quick question.
Can Amber perform minimization if the pdb provided has no info about the
atoms coordinates ?
i. e let's admit we have something like that:
ATOM 1 N LYS 1 0.000 0.000 0.000
ATOM 2 H1 LYS 1 0.000 0.000 0.000
ATOM 3 H2 LYS 1 0.000 0.000 0.000
But all the residues are correctly numbered, and the atoms correctlt named.
Regards
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Received on Tue Apr 29 2014 - 08:30:03 PDT
