--- trunk/src/applications/dynamicProps/DynamicPropsCmd.h 2011/05/19 14:28:04 1565 +++ trunk/src/applications/dynamicProps/DynamicPropsCmd.h 2014/06/01 19:28:44 2003 @@ -1,12 +1,12 @@ -/** @file cmdline.h +/** @file DynamicPropsCmd.h * @brief The header file for the command line option parser * generated by GNU Gengetopt version 2.22.4 * http://www.gnu.org/software/gengetopt. * DO NOT modify this file, since it can be overwritten * @author GNU Gengetopt by Lorenzo Bettini */ -#ifndef CMDLINE_H -#define CMDLINE_H +#ifndef DYNAMICPROPSCMD_H +#define DYNAMICPROPSCMD_H /* If we use autoconf. */ #ifdef HAVE_CONFIG_H @@ -54,15 +54,28 @@ struct gengetopt_args_info int order_arg; /**< @brief Lengendre Polynomial Order. */ char * order_orig; /**< @brief Lengendre Polynomial Order original value given at command line. */ const char *order_help; /**< @brief Lengendre Polynomial Order help description. */ + int nzbins_arg; /**< @brief Number of Z bins (default='100'). */ + char * nzbins_orig; /**< @brief Number of Z bins original value given at command line. */ + const char *nzbins_help; /**< @brief Number of Z bins help description. */ + char * memory_arg; /**< @brief Available memory (defaults to 2G) (default='2G'). */ + char * memory_orig; /**< @brief Available memory (defaults to 2G) original value given at command line. */ + const char *memory_help; /**< @brief Available memory (defaults to 2G) help description. */ + const char *selecorr_help; /**< @brief selection correlation function help description. */ const char *rcorr_help; /**< @brief rmsd help description. */ const char *vcorr_help; /**< @brief velocity correlation function help description. */ const char *dcorr_help; /**< @brief dipole correlation function help description. */ const char *lcorr_help; /**< @brief Lengendre correlation function help description. */ + const char *lcorrZ_help; /**< @brief Lengendre correlation function binned by Z help description. */ + const char *cohZ_help; /**< @brief Lengendre correlation function for OH bond vectors binned by Z help description. */ + const char *sdcorr_help; /**< @brief System dipole correlation function help description. */ const char *r_rcorr_help; /**< @brief Radial rmsd help description. */ const char *thetacorr_help; /**< @brief Angular rmsd help description. */ const char *drcorr_help; /**< @brief Directional rmsd for particles with unit vectors help description. */ const char *helfandEcorr_help; /**< @brief Helfand moment for thermal conductvity help description. */ + const char *momentum_help; /**< @brief Helfand momentum for viscosity help description. */ const char *stresscorr_help; /**< @brief Stress tensor correlation function help description. */ + const char *bondcorr_help; /**< @brief Bond extension correlation function help description. */ + const char *freqfluccorr_help; /**< @brief Frequency Fluctuation correlation function help description. */ unsigned int help_given ; /**< @brief Whether help was given. */ unsigned int version_given ; /**< @brief Whether version was given. */ @@ -71,16 +84,27 @@ struct gengetopt_args_info unsigned int sele1_given ; /**< @brief Whether sele1 was given. */ unsigned int sele2_given ; /**< @brief Whether sele2 was given. */ unsigned int order_given ; /**< @brief Whether order was given. */ + unsigned int nzbins_given ; /**< @brief Whether nzbins was given. */ + unsigned int memory_given ; /**< @brief Whether memory was given. */ + unsigned int selecorr_given ; /**< @brief Whether selecorr was given. */ unsigned int rcorr_given ; /**< @brief Whether rcorr was given. */ unsigned int vcorr_given ; /**< @brief Whether vcorr was given. */ unsigned int dcorr_given ; /**< @brief Whether dcorr was given. */ unsigned int lcorr_given ; /**< @brief Whether lcorr was given. */ + unsigned int lcorrZ_given ; /**< @brief Whether lcorrZ was given. */ + unsigned int cohZ_given ; /**< @brief Whether cohZ was given. */ + unsigned int sdcorr_given ; /**< @brief Whether sdcorr was given. */ unsigned int r_rcorr_given ; /**< @brief Whether r_rcorr was given. */ unsigned int thetacorr_given ; /**< @brief Whether thetacorr was given. */ unsigned int drcorr_given ; /**< @brief Whether drcorr was given. */ unsigned int helfandEcorr_given ; /**< @brief Whether helfandEcorr was given. */ + unsigned int momentum_given ; /**< @brief Whether momentum was given. */ unsigned int stresscorr_given ; /**< @brief Whether stresscorr was given. */ + unsigned int bondcorr_given ; /**< @brief Whether bondcorr was given. */ + unsigned int freqfluccorr_given ; /**< @brief Whether freqfluccorr was given. */ + char **inputs ; /**< @brief unamed options (options without names) */ + unsigned inputs_num ; /**< @brief unamed options number */ int dynamicProps_group_counter; /**< @brief Counter for group dynamicProps */ } ; @@ -207,4 +231,4 @@ int cmdline_parser_required (struct gengetopt_args_inf #ifdef __cplusplus } #endif /* __cplusplus */ -#endif /* CMDLINE_H */ +#endif /* DYNAMICPROPSCMD_H */