[sharp-discuss] hatom file output

Roni Gordon rgordon at uhnresearch.ca
Tue May 29 15:53:02 BST 2007


Hi all,

Just trying to figure out where to find / how to produce the hatom file
that's required to skip the HASEARCH step in autoSHARP.  The manual
talks about orthogonalizing a PDB-style file, but I figured that SHARP
would simply produce a file that I could pump back in... or is this
meant to be done via the site editor?  

Any help would be appreciated.

Roni




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