namd cvs 26.06.09, tcl 8.5, loadcoords

From: Vlad Cojocaru (Vlad.Cojocaru_at_eml-r.villa-bosch.de)
Date: Mon Jun 29 2009 - 09:10:46 CDT

Dear NAMD users,

I noticed that when the cvs code of namd (on 26th of June 2009) was
compiled using tcl 8.5.7 (with gcc 4.1) on a x86_64 arch, I got a rather
unexpected behavior of the tcl command "loadcoords". This command
instead of returning a tcl array , it returns a tcl list in which each
element of the list is a list with the coordinates of the atoms and
groups defined. The coordinates are what I expect but of course this
means I need to change the script accordingly ...

Has somebody already observed this ? If yes, is this valid for
loadforces and loadtotalforces ?
If this was not observed by anybody else, I will do more tests to see if
this is reproducible with the tclforces tutorial files ...

Thanks
Best wishes
Vlad

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Dr. Vlad Cojocaru
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e-mail:Vlad.Cojocaru[at]eml-r.villa-bosch.de
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