Mol2db: Difference between revisions
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ui.c reads the inhier parameter file and sets variables | ui.c reads the inhier parameter file and sets variables | ||
hiergen.c uses the multiple conformations to construct the hierarchy data structure (in a yet to be discovered way) | |||
Revision as of 00:47, 14 November 2009
mol2db is a program developed to combine multimol2 files into the Flexibase format read by DOCK.
The purpose of this page is to document how mol2db works and any changes made to mol2db, and is not necessarily a guide to preparing files to run or running them through mol2db.
ui.c reads the inhier parameter file and sets variables
hiergen.c uses the multiple conformations to construct the hierarchy data structure (in a yet to be discovered way)