Re: [AMBER] Please how to solve the unfilled valence problem in antechamber

From: David Case <david.case.rutgers.edu>
Date: Sat, 28 Sep 2019 12:46:49 +0000

On Wed, Sep 25, 2019, Renato Araujo wrote:

>Weird atomic valence (1) for atom (ID: 1, Name: C1).
> Possible open valence.

Have you checked your input geometry around atom C1? Note that all
hydrogens must be present in files to send to antechamber. If you can't
figure it out, you will need to post your input structure.

....dac


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Received on Sat Sep 28 2019 - 06:00:05 PDT
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