Re: [AMBER] Number of atoms in the coordinate file does not match the parm file when assigning ntwprt value

From: Bill Ross <>
Date: Sat, 15 Aug 2020 21:21:03 -0700

What if you retry deleting in a copy of the pdb. and this time count


On 8/15/20 9:00 PM, 李奕言 wrote:
> I tried to delete the non-protein atoms in the original pdb file and to regenerate a protein-only parm file, yet unfortunately I miscounted the number of atoms in the protein (8872) and an 8873 number of atoms resulted in
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Received on Sat Aug 15 2020 - 21:30:02 PDT
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