#
#     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 VERSION CCP4Interface 0.2
#CCP4I SCRIPT DEF areaimol
#CCP4I DATE  25/06/97 16:05:30
#CCP4I USER pjx

#CCP4i_cvs_Id $Id$

TITLE		_title_text	           ""

INPUT_FILES     _list_of_text              XYZIN
OUTPUT_FILES    _list_of_text              ""

XYZIN           _pdb_file                  ""
DIR_XYZIN       _default_dirs              ""
XYZIN2          _pdb_file                  ""
DIR_XYZIN2      _default_dirs              ""
XYZOUT          _pdb_file                  ""
DIR_XYZOUT      _default_dirs              ""

WRITE_OUTPUT_FILE _logical                 1

AREAIMOL_PROTOCOL _areaimol_protocol       ASA
DIFFMODE          _text                    "OFF"

WATERS_MODE     _areaimol_mode             NOHOH
SYMMETRY_MODE   _logical                   0
IMOL_CONTACTS   _text                      "NONE"
SPACE_GROUP     _space_group               ""
USE_TRANSLATIONS _logical                  0

SYMM_SOURCE     _areaimol_symm_source      SPGRP
NSYMM           _positiveint               0
SYMOP,0         _text                      ""

LIGAND_CHAINS   _text                      ""
PROTEIN_CHAINS  _text                      ""

NMOLS           _positiveint               1
MOL_NAME,0      _text                      ""
MOL_CHAINS,0    _text                      ""
MOL_NAME,1      _text                      ""
MOL_CHAINS,1    _text                      ""

PNTDEN          _positiveint               10
PROBE_RADIUS    _positivereal              1.4

N_ATOMS         _positiveint               0
ATOM_NAME,0     _text                      ""
ATOM_NUMBER,0   _text                      ""
ATOM_RADIUS,0   _positivereal              ""

REPORT_CONTACT  _logical                   1
REPORT_RESAREA  _logical                   1

