TITLE: Orientation

EXECUTABLES TESTED:  
	dock6

FUNCTIONS TESTED:
	Orient Ligand Parameters
	
WALL CLOCK TIME:
	1.53 secs

FILES USED:
	orient1.dockin		#automated matching (single)
	orient2.dockin		#manual matching
	orient3.dockin		#use ligand spheres
        orient4.dockin          #automated matching (library)
	lig.mol2		#ligand structure file
	multi_lig.mol2		#multiple ligand structure file
	struct.sph		#receptor sphere file
	lig.sph			#ligand sphere file
	chem.defn		#chem parameter input file
	flex.defn		#flex atom definition file
	flex_drive.tbl		#flex torsional drive file
	vdw.defn		#vdw parameter file used to create grid

FILES GENERATED:
	XXX_orients.mol2	#orientations from input file
	XXX_scored.mol2		#best scoring pose from input file	
