[gmx-developers] g_chi

Graham Smith smithgr at cancer.org.uk
Thu Sep 5 20:37:01 CEST 2002


Hi - 

A couple of weeks ago I sent David a modified version of g_chi which
he was kind enough to put on CVS. Unfortunately I've found that it can
coredump if -maxchi is small or zero. Duh.  The attached version
contains fixes that stop it doing that, (and adds yet another new
command line option). Could one of you add it to CVS?  (despite what I
did before, I presume this is the correct place to send this sort of
stuff?)

(decode and uncompress)
in src/tools 
tar -xvPf newchi_sep02.tar
rm pp2shift.h (ie the old version in src/tools, not the new 
version in include)

Thanks 

-Graham 

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`
end


########################################################################

Dr. Graham R. Smith, 		       Department of Biological Sciences,  
Biomolecular Modelling Laboratory,     Biochemistry Building,              	
Cancer Research UK, 		       Imperial College of Science,        	
44 Lincoln's Inn Fields, 	        Technology & Medicine,             	
London WC2A 3PX,		       London SW7 2AZ,                     	
U.K. 				       U.K.                                	
Tel: +44-(0)20 7269 3348 	       Tel: +44-(0)20 7594 5737            	
email: graham.smith at cancer.org.uk	
URL: http://www.bmm.icnet.uk/~smithgr



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