AMBER Archive (2008)
Subject: AMBER: AmberTools1.1 (and 1.0) antechamber endless loop
From: Grange Hermitage (ghermitage_at_gmail.com)
I am getting an endless loop with AmberTools1.1 and 1.0 installations on
The command is:
antechamber -fi mol2 -fo prepi -i chp3.mol2 -o chp3.prepin -j 5 -c bcc -s 2
The chp3.mol2 is attached.
Perhaps one of the developers could execute this in their AmberTools
I have a tgz of the directory used for the run, and will send if anyone
Is a different means of reporting a possible bug recommended?
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