ichimain.c File Reference

#include <stdio.h>
#include <stdlib.h>
#include <string.h>
#include <ctype.h>
#include <stdarg.h>
#include <errno.h>
#include <limits.h>
#include <float.h>
#include <locale.h>
#include <conio.h>
#include <windows.h>
#include "../../../INCHI_BASE/src/mode.h"
#include "../../../INCHI_BASE/src/ichitime.h"
#include "../../../INCHI_BASE/src/incomdef.h"
#include "../../../INCHI_BASE/src/ichidrp.h"
#include "../../../INCHI_BASE/src/inpdef.h"
#include "../../../INCHI_BASE/src/ichi.h"
#include "../../../INCHI_BASE/src/strutil.h"
#include "../../../INCHI_BASE/src/util.h"
#include "../../../INCHI_BASE/src/ichierr.h"
#include "../../../INCHI_BASE/src/ichimain.h"
#include "../../../INCHI_BASE/src/ichicomp.h"
#include "../../../INCHI_BASE/src/ichi_io.h"
#include "../../../INCHI_BASE/src/bcf_s.h"
#include "../../../INCHI_BASE/src/permutation_util.h"

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Functions
int	main (int argc, char *argv[])
void	save_command_line (int argc, char *argv[], INCHI_IOSTREAM *plog)
void	emit_empty_inchi (INPUT_PARMS *ip, long num_inp, char *pLF, char *pTAB, INCHI_IOSTREAM *pout)
int	GetTheNextRecordOfInputFile (struct tagINCHI_CLOCK *ic, STRUCT_DATA *sd, INPUT_PARMS *ip, char *szTitle, INCHI_IOSTREAM *inp_file, INCHI_IOSTREAM *plog, INCHI_IOSTREAM *pout, INCHI_IOSTREAM *pprb, ORIG_ATOM_DATA *orig_inp_data, long *num_inp, STRUCT_FPTRS *pStructPtrs, int *nRet, int *have_err_in_GetOneStructure, long *num_err, int output_error_inchi)
int	CalcAndPrintINCHIAndINCHIKEY (struct tagINCHI_CLOCK *ic, CANON_GLOBALS *CG, STRUCT_DATA *sd, INPUT_PARMS *ip, char *szTitle, PINChI2 *pINChI[INCHI_NUM], PINChI_Aux2 *pINChI_Aux[INCHI_NUM], INCHI_IOSTREAM *inp_file, INCHI_IOSTREAM *plog, INCHI_IOSTREAM *pout, INCHI_IOSTREAM *pprb, ORIG_ATOM_DATA *orig_inp_data, ORIG_ATOM_DATA *prep_inp_data, long *num_inp, STRUCT_FPTRS *pStructPtrs, int *nRet, int have_err_in_GetOneStructure, long *num_err, int output_error_inchi, INCHI_IOS_STRING *strbuf, unsigned long *pulTotalProcessingTime, char *pLF, char *pTAB, char *ikey, int silent)

Variables
int	bInterrupted = 0

Function Documentation

CalcAndPrintINCHIAndINCHIKEY()

int CalcAndPrintINCHIAndINCHIKEY	(	struct tagINCHI_CLOCK *	ic,
		CANON_GLOBALS *	CG,
		STRUCT_DATA *	sd,
		INPUT_PARMS *	ip,
		char *	szTitle,
		PINChI2 *	pINChI[INCHI_NUM],
		PINChI_Aux2 *	pINChI_Aux[INCHI_NUM],
		INCHI_IOSTREAM *	inp_file,
		INCHI_IOSTREAM *	plog,
		INCHI_IOSTREAM *	pout,
		INCHI_IOSTREAM *	pprb,
		ORIG_ATOM_DATA *	orig_inp_data,
		ORIG_ATOM_DATA *	prep_inp_data,
		long *	num_inp,
		STRUCT_FPTRS *	pStructPtrs,
		int *	nRet,
		int	have_err_in_GetOneStructure,
		long *	num_err,
		int	output_error_inchi,
		INCHI_IOS_STRING *	strbuf,
		unsigned long *	pulTotalProcessingTime,
		char *	pLF,
		char *	pTAB,
		char *	ikey,
		int	silent
	)

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emit_empty_inchi()

void emit_empty_inchi	(	INPUT_PARMS *	ip,
		long	num_inp,
		char *	pLF,
		char *	pTAB,
		INCHI_IOSTREAM *	pout
	)

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GetTheNextRecordOfInputFile()

int GetTheNextRecordOfInputFile	(	struct tagINCHI_CLOCK *	ic,
		STRUCT_DATA *	sd,
		INPUT_PARMS *	ip,
		char *	szTitle,
		INCHI_IOSTREAM *	inp_file,
		INCHI_IOSTREAM *	plog,
		INCHI_IOSTREAM *	pout,
		INCHI_IOSTREAM *	pprb,
		ORIG_ATOM_DATA *	orig_inp_data,
		long *	num_inp,
		STRUCT_FPTRS *	pStructPtrs,
		int *	nRet,
		int *	have_err_in_GetOneStructure,
		long *	num_err,
		int	output_error_inchi
	)

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main()

int main	(	int	argc,
		char *	argv[]
	)

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save_command_line()

void save_command_line	(	int	argc,
		char *	argv[],
		INCHI_IOSTREAM *	plog
	)

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Variable Documentation

bInterrupted

int bInterrupted = 0