Subject: Non-integral charge problem:AutoDockTools

From: amor san juan <[email-masked]>
Date: Wed, 3 Apr 2002 03:02:11 -0800 (PST)

Fellow dockers:

Nice day to all!

Would someone please help me in preparing
macromolecules for docking. Under AutoDockTools, I
encountered hanging of the program after reading the
pdb macromolecule file. The warning displays
"non-integral charge".

Any ideas will be appreciated.

Amor San Juan
University of the Philippines

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