AMBER: ptraj: projection command missing in dispatch.c (AMBER 10)

From: Vlad Cojocaru <Vlad.Cojocaru.eml-r.villa-bosch.de>
Date: Tue, 15 Jul 2008 15:45:11 +0200

Dear ambers,

I noticed that the "projection" action command in ptraj is missing in
the dispatch.c file in the AmberTools 1.0 distribution. Therefore when I
attempted to run a PCA, the projection command failed with an error
indicating "unknown action type".

The solution is to introduce the line below in the dispatch.c form ptraj
of AmberTools 1.0 at line 305

 {"projection", 10, -1, TRANSFORM_PROJECTION, ptrajSetup},

Best wishes
vlad 

-- 
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Dr. Vlad Cojocaru
EML Research gGmbH
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e-mail:Vlad.Cojocaru[at]eml-r.villa-bosch.de
http://projects.villa-bosch.de/mcm/people/cojocaru/
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Received on Wed Jul 16 2008 - 06:07:35 PDT
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