--- trunk/src/applications/sequentialProps/SequentialPropsCmd.h 2014/11/04 15:31:51 2035 +++ trunk/src/applications/sequentialProps/SequentialPropsCmd.h 2015/03/17 18:22:18 2081 @@ -57,6 +57,12 @@ struct gengetopt_args_info int nbins_z_arg; /**< @brief number of bins in z axis (default='100'). */ char * nbins_z_orig; /**< @brief number of bins in z axis original value given at command line. */ const char *nbins_z_help; /**< @brief number of bins in z axis help description. */ + double centroidX_arg; /**< @brief Location of droplet centroid in x. */ + char * centroidX_orig; /**< @brief Location of droplet centroid in x original value given at command line. */ + const char *centroidX_help; /**< @brief Location of droplet centroid in x help description. */ + double centroidY_arg; /**< @brief Location of droplet centroid in y. */ + char * centroidY_orig; /**< @brief Location of droplet centroid in y original value given at command line. */ + const char *centroidY_help; /**< @brief Location of droplet centroid in y help description. */ double referenceZ_arg; /**< @brief Reference z-height of solid surface. */ char * referenceZ_orig; /**< @brief Reference z-height of solid surface original value given at command line. */ const char *referenceZ_help; /**< @brief Reference z-height of solid surface help description. */ @@ -66,6 +72,9 @@ struct gengetopt_args_info double threshDens_arg; /**< @brief Threshold Density in g/cm^3. */ char * threshDens_orig; /**< @brief Threshold Density in g/cm^3 original value given at command line. */ const char *threshDens_help; /**< @brief Threshold Density in g/cm^3 help description. */ + double bufferLength_arg; /**< @brief Buffer length in angstroms. */ + char * bufferLength_orig; /**< @brief Buffer length in angstroms original value given at command line. */ + const char *bufferLength_help; /**< @brief Buffer length in angstroms help description. */ const char *com_help; /**< @brief selection center of mass help description. */ const char *ca1_help; /**< @brief contact angle of selection (using center of mass) help description. */ const char *ca2_help; /**< @brief contact angle of selection (using density profile) help description. */ @@ -78,9 +87,12 @@ struct gengetopt_args_info unsigned int sele2_given ; /**< @brief Whether sele2 was given. */ unsigned int nbins_given ; /**< @brief Whether nbins was given. */ unsigned int nbins_z_given ; /**< @brief Whether nbins_z was given. */ + unsigned int centroidX_given ; /**< @brief Whether centroidX was given. */ + unsigned int centroidY_given ; /**< @brief Whether centroidY was given. */ unsigned int referenceZ_given ; /**< @brief Whether referenceZ was given. */ unsigned int dropletR_given ; /**< @brief Whether dropletR was given. */ unsigned int threshDens_given ; /**< @brief Whether threshDens was given. */ + unsigned int bufferLength_given ; /**< @brief Whether bufferLength was given. */ unsigned int com_given ; /**< @brief Whether com was given. */ unsigned int ca1_given ; /**< @brief Whether ca1 was given. */ unsigned int ca2_given ; /**< @brief Whether ca2 was given. */