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/*
* $Id: filenm.h,v 1.27 2005/06/02 12:45:42 spoel Exp $
*
* This source code is part of
*
* G R O M A C S
*
* GROningen MAchine for Chemical Simulations
*
* VERSION 3.2.0
* Written by David van der Spoel, Erik Lindahl, Berk Hess, and others.
* Copyright (c) 1991-2000, University of Groningen, The Netherlands.
* Copyright (c) 2001-2004, The GROMACS development team,
* check out http://www.gromacs.org for more information.
* This program is free software; you can redistribute it and/or
* modify it under the terms of the GNU General Public License
* as published by the Free Software Foundation; either version 2
* of the License, or (at your option) any later version.
*
* If you want to redistribute modifications, please consider that
* scientific software is very special. Version control is crucial -
* bugs must be traceable. We will be happy to consider code for
* inclusion in the official distribution, but derived work must not
* be called official GROMACS. Details are found in the README & COPYING
* files - if they are missing, get the official version at www.gromacs.org.
*
* To help us fund GROMACS development, we humbly ask that you cite
* the papers on the package - you can find them in the top README file.
*
* For more info, check our website at http://www.gromacs.org
*
* And Hey:
* GRoups of Organic Molecules in ACtion for Science
*/
#ifdef HAVE_CONFIG_H
#include <config.h>
#endif
/* this enum should correspond to the array deffile in gmxlib/filenm.c */
enum {
efMDP, efGCT,
efTRX, efTRN, efTRR, efNH5, efTRJ, efXTC, efG87,
efENX, efEDR, efENE,
efSTX, efSTO, efGRO, efG96, efPDB, efBRK, efENT, efESP, efPQR,
efLOG, efXVG, efOUT,
efNDX,
efTOP, efITP,
efTPX, efTPS, efTPR, efTPA, efTPB,
#ifdef HAVE_LIBXML2
efXML,
#endif
efTEX, efRTP, efATP, efHDB,
efDAT, efDLG,
efMAP, efEPS, efMAT, efM2P,
efMTX,
efEDI, efEDO,
efPPA, efPDO,
efHAT,
efXPM,
efNR
};
typedef struct {
int ftp; /* File type (see enum above) */
char *opt; /* Command line option */
char *fn; /* File name (as set in source code) */
unsigned long flag; /* Flag for all kinds of info (see defs)*/
int nfiles; /* number of files */
char **fns; /* File names */
} t_filenm;
#define ffSET 1<<0
#define ffREAD 1<<1
#define ffWRITE 1<<2
#define ffOPT 1<<3
#define ffLIB 1<<4
#define ffMULT 1<<5
#define ffRW (ffREAD | ffWRITE)
#define ffOPTRD (ffREAD | ffOPT)
#define ffOPTWR (ffWRITE| ffOPT)
#define ffOPTRW (ffRW | ffOPT)
#define ffLIBRD (ffREAD | ffLIB)
#define ffLIBOPTRD (ffOPTRD | ffLIB)
#define ffRDMULT (ffREAD | ffMULT)
#define ffOPTRDMULT (ffRDMULT | ffOPT)
#define ffWRMULT (ffWRITE | ffMULT)
#define ffOPTWRMULT (ffWRMULT | ffOPT)
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