dear colleagues and friends
Someone, please help me resolve this error:
I am using the following command
antechamber -fi ac -i input.ac -c wc -cf input.crg
And this happening:
Welcome to antechamber 17.3: molecular input file processor.
acdoctor mode is on: check and diagnosis problems in the input file.
- Check Format for ac File -
Status: pass
- Check Unusual Elements -
Status: pass
- Check Open Valences -
Status: pass
- Check Geometry -
for those bonded
for those not bonded
Status: pass
- Check Weird Bonds -
/ usr / local / Chem / amber18 / bin / to_be_dispatched / antechamber:
Fatal Error!
Weird atomic valence (1) for atom (ID: 1, Name: C1).
Possible open valence.
How to solve ?
Thanks
Dr Renato Costa
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Received on Wed Sep 25 2019 - 10:30:03 PDT
