On Fri, Jan 23, 2009, prachi munjal wrote:
>
>
> antechamber -i ATP_1.mol2 -fi mol2 -o ATP_1charges.mol2 -fo mol2 -c bcc -nc
> -4.0
Works fine for me. What version of antechamber are you using?
{Note, the argument to -nc should be "4" not "4.0", but on my machine,
either one works.}
....dac
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Received on Sun Jan 25 2009 - 01:11:05 PST
