/* * International Union of Pure and Applied Chemistry (IUPAC) * International Chemical Identifier (InChI) * Version 1 * Software version 1.01 * July 21, 2006 * Developed at NIST */ #ifndef __INCHIERR_H__ #define __INCHIERR_H__ #define _IS_OKAY 0 #define _IS_WARNING 1 #define _IS_ERROR 2 /* Microsoft defined its own IS_ERROR() macro */ #define _IS_FATAL 3 #define _IS_UNKNOWN 4 /* unknown error: used in INChI DLL only */ #define _IS_EOF -1 /* end of file */ #define _IS_SKIP -2 #define CT_ERR_FIRST (-30000) #define CT_OVERFLOW (CT_ERR_FIRST- 0) /*(-30000) */ #define CT_LEN_MISMATCH (CT_ERR_FIRST- 1) /*(-30001) */ #define CT_OUT_OF_RAM (CT_ERR_FIRST- 2) /*(-30002) */ #define CT_RANKING_ERR (CT_ERR_FIRST- 3) /*(-30003) */ #define CT_ISOCOUNT_ERR (CT_ERR_FIRST- 4) /*(-30004) */ #define CT_TAUCOUNT_ERR (CT_ERR_FIRST- 5) /*(-30005) */ #define CT_ISOTAUCOUNT_ERR (CT_ERR_FIRST- 6) /*(-30006) */ #define CT_MAPCOUNT_ERR (CT_ERR_FIRST- 7) /*(-30007) */ #define CT_TIMEOUT_ERR (CT_ERR_FIRST- 8) /*(-30008) */ #define CT_ISO_H_ERR (CT_ERR_FIRST- 9) /*(-30009) */ #define CT_STEREOCOUNT_ERR (CT_ERR_FIRST-10) /*(-30010) */ #define CT_ATOMCOUNT_ERR (CT_ERR_FIRST-11) /*(-30011) */ #define CT_STEREOBOND_ERROR (CT_ERR_FIRST-12) /*(-30012) */ #define CT_USER_QUIT_ERR (CT_ERR_FIRST-13) /*(-30013) */ #define CT_REMOVE_STEREO_ERR (CT_ERR_FIRST-14) /*(-30014) */ #define CT_CALC_STEREO_ERR (CT_ERR_FIRST-15) /*(-30015) */ #define CT_CANON_ERR (CT_ERR_FIRST-16) /*(-30016) */ #define CT_STEREO_CANON_ERR (CT_ERR_FIRST-17) /*(-30017) */ #define CT_WRONG_FORMULA (CT_ERR_FIRST-18) /*(-30017) */ #define CT_UNKNOWN_ERR (CT_ERR_FIRST-19) /*(-30019) */ #define CT_ERR_MIN CT_UNKNOWN_ERR #define CT_ERR_MAX CT_ERR_FIRST #define CHECK_OVERFLOW(Len, Maxlen) ( (Len) >= (Maxlen) ) #define RETURNED_ERROR(nVal) (CT_ERR_MIN<=(nVal) && (nVal)<=CT_ERR_MAX) #define BNS_ERR -9999 #define BNS_WRONG_PARMS (BNS_ERR + 0) /*(-9999)*/ #define BNS_OUT_OF_RAM (BNS_ERR + 1) /*(-9998)*/ #define BNS_PROGRAM_ERR (BNS_ERR + 2) /*(-9997)*/ #define BNS_ALTPATH_OVFL (BNS_ERR + 3) /*(-9996)*/ #define BNS_BOND_ERR (BNS_ERR + 4) /*(-9995)*/ #define BNS_VERT_NUM_ERR (BNS_ERR + 5) /*(-9994)*/ #define BNS_VERT_EDGE_OVFL (BNS_ERR + 6) /*(-9993)*/ #define BNS_SET_ALTP_ERR (BNS_ERR + 7) /*(-9992)*/ #define BNS_CPOINT_ERR (BNS_ERR + 8) /*(-9991)*/ #define BNS_CANT_SET_BOND (BNS_ERR + 9) /*(-9990)*/ #define BNS_CAP_FLOW_ERR (BNS_ERR + 10) /*(-9989)*/ #define BNS_RADICAL_ERR (BNS_ERR + 11) /*(-9988)*/ #define BNS_REINIT_ERR (BNS_ERR + 12) /*(-9987)*/ #define BNS_ALTBOND_ERR (BNS_ERR + 13) /*(-9986)*/ #define BNS_MAX_ERR_VALUE (BNS_ERR + 19) /*(-9980)*/ #define IS_BNS_ERROR(X) (BNS_ERR <= (X) && (X) <= BNS_MAX_ERR_VALUE) #define INCHI_INP_ERROR_ERR 40 #define INCHI_INP_ERROR_RET (-1) #define INCHI_INP_FATAL_ERR 1 #define INCHI_INP_FATAL_RET 0 #define INCHI_INP_EOF_ERR 11 #define INCHI_INP_EOF_RET 0 #ifndef INCHI_ALL_CPP #ifdef __cplusplus extern "C" { #endif #endif extern int (*UserAction)(void); /* callback */ extern int (*ConsoleQuit)(void); /* Console user issued CTRL+C etc. */ #ifndef INCHI_ALL_CPP #ifdef __cplusplus } #endif #endif #define LOG_MASK_WARN 1 #define LOG_MASK_ERR 2 #define LOG_MASK_FATAL 4 #define LOG_MASK_ALL (LOG_MASK_WARN | LOG_MASK_ERR | LOG_MASK_FATAL) #define LOG_MASK_NO_WARN (LOG_MASK_ERR | LOG_MASK_FATAL) #ifdef INCHI_LIB #include #ifndef INCHI_ALL_CPP #ifdef __cplusplus extern "C" { #endif #endif extern void (*FWPRINT) (const char * format, va_list argptr ); extern void (*DRAWDATA) ( struct DrawData * pDrawData); extern int (*DRAWDATA_EXISTS) ( int nComponent, int nType, int bReconnected ); extern struct DrawData * (*GET_DRAWDATA) ( int nComponent, int nType, int bReconnected ); #ifndef INCHI_ALL_CPP #ifdef __cplusplus } #endif #endif #endif #define USER_ACTION_QUIT 1 #endif /* __INCHIERR_H__ */