[AMBER] antechamber charge method?

From: Zahra Khatti <khatti_za.yahoo.com>
Date: Sat, 4 Jan 2014 14:47:28 +0000 (GMT)

Dear amberists

I used gasteiger charge method for antechamber running that have many
approximation.  Since AM1-BCC method was used, I get an error and
 properly exit. I don't know why? I get this error...

Running: /home/khatti/amber12/bin/sqm -O -i sqm.in -o sqm.out
Error: cannot run "/home/khatti/amber12/bin/sqm -O -i sqm.in -o sqm.out" of bcc() in charge.c properly, exit

Z. Khatti, Ph.D student of Physical Chemistry,
Department of Chemistry, Iran University of Science & Technology,Tehran, Iran 
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Received on Sat Jan 04 2014 - 07:00:04 PST
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