#
#     Copyright (C) 1999-2004  Liz Potterton, Peter Briggs
#
#     This code is distributed under the terms and conditions of the
#     CCP4 Program Suite Licence Agreement as a CCP4 Library.
#     A copy of the CCP4 licence can be obtained by writing to the
#     CCP4 Secretary, Daresbury Laboratory, Warrington WA4 4AD, UK.
#
#CCP4i_cvs_Id $Id$
#CCP4I VERSION CCP4Interface 0.11
#CCP4I SCRIPT DEF rsps
#CCP4I DATE  4/08/98 16:05:30
#CCP4I USER lizp

TITLE       		_title_text     	""
INPUT_FILES 		_list_of_text		"PATFILE"
OUTPUT_FILES		_list_of_text		""

RSPS_INPUT		_rsps_input		SCAN
RSPS_MODE		_rsps_mode		GETSETS

PATFILE			_map_file		""
DIR_PATFILE		_default_dirs		TEMPORARY
HPEAKSFIL		_pdb_file		""
DIR_HPEAKSFIL		_default_dirs		""
XPEAKSFIL		_pdb_file		""
DIR_XPEAKSFIL		_default_dirs		""
NINSITESFILE		_positiveint		1
INSITESFILE,0		_pdb_file		""
DIR_INSITESFILE,0	_default_dirs		""


IFHARKERSCAN		_logical		1
HARKER_LOW		_positiveint		2
HARKER_REJECT		_positivereal		""
PICK_HARKER_N		_positiveint		50
PICK_SCORMAP_LEVEL	_positivereal		""

SPACE_GROUP     	_space_group    	""
IFXYZLIM		_logical		0
XYZLIM_1        	_real   		""
XYZLIM_2        	_real   		""
XYZLIM_3        	_real  	 		""
XYZLIM_4        	_real   		""
XYZLIM_5        	_real   		""
XYZLIM_6        	_real   		""
IFGRID			_logical		1
GRID_1			_positiveint		""
GRID_2			_positiveint		""
GRID_3			_positiveint		""
IFCELL			_logical		0
CELL_1			_cell_length		""
CELL_2			_cell_length		""
CELL_3			_cell_length		""
CELL_4			_cell_angle		""
CELL_5			_cell_angle		""
CELL_6			_cell_angle		""

IFNCS			_logical		0
NCS_NOPS		_positiveint		0
NCS_OP_ALPHA,0		_real			""
NCS_OP_BETA,0		_real			""
NCS_OP_GAMMA,0		_real			""
NCS_OP_XTRAN,0		_real			""
NCS_OP_YTRAN,0		_real			""
NCS_OP_ZTRAN,0		_real			""

N_FIXED			_positivereal		0
FIXED_SITE,0		_positivereal		""

IFGETSETS		_logical		1
GETSETS_MIN		_positivereal		3
GETSETS_USE		_positivereal		50
GETSETS_REJECT		_positivereal		""
GETSETS_LOW		_positiveint		6

IFCROSSPEAKS		_logical		0
N_CROSS_PEAKS		_positiveint		1
CROSS_REJECT		_positivereal		""
CROSS_LOW		_positiveint		6
CROSS_SCAN_SCORE_MODE   _rsps_score_mode	SUM
CROSS_SCAN_SCORE_N	_positiveint		""
PICK_CROSS_N		_positiveint		50
X_LIST_HARKER_N		_positiveint		10