AMBER Archive (2008)

Subject: AMBER: RED III execution problem

From: ben rodriguez (
Date: Wed Jul 02 2008 - 20:24:19 CDT

I am trying to generate RESP charges using RED III, and GAMESS. I get this error from the RED log file:

  ======================= Single molecule ===========================
         The molecule TITLE is "HOP"
                The TOTAL CHARGE value of the molecule is "0"
              The SPIN MULTIPLICITY value of the molecule is "1"

                        Unknown output detected !
                      Invalid optimization OUTPUT !

I have a feeling this is a trivial error, and have searched the archives for these errors but have not found anything. If someone could point me in the right direction I would appreciate it.

Ben Rodriguez

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