{+ file: mtf_to_psf.inp +} {+ directory: general +} {+ description: Convert a MTF format file to PSF format +} {+ authors: Axel T. Brunger, and Paul D. Adams +} {+ copyright: Yale University +} {- Guidelines for using this file: - all strings must be quoted by double-quotes - logical variables (true/false) are not quoted - do not remove any evaluate statements from the file -} {- begin block parameter definition -} define( {======================= molecular structure =========================} {* input molecular topology file in MTF format *} {===>} structure_infile="amy.mtf"; {============================= output files ================================} {* output molecular topology file in PSF format *} {===>} psf_outfile="mtf_to_psf.psf"; {===========================================================================} { things below this line do not normally need to be changed } {===========================================================================} ) {- end block parameter definition -} checkversion 1.3 structure @@&structure_infile end write psf output=&psf_outfile end stop