Hi,
I would like to use the charges included in the Jaguar Output (for a small
organic molecule) in Antechamber to generated the mol2 file. How I could
do this?
I have tried
antechamber -i jag_name.out -fi jout -o name.mol2 -fo mol2 -c rc
but it generates an error: Cannot open file () with mode (r)
Thank you,
Sofia
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Received on Mon Jul 01 2019 - 07:30:02 PDT
