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40 static char *SRCID_nsb_h = "$Id$";
45 extern void calc_nsbshift(FILE *fp,t_nsborder *nsb);
46 /* Calculates the shift and bshift variables */
48 extern void calc_nsb(FILE *fp,t_block *cgs,int nprocs,
49 t_nsborder *nsb,int nstDlb);
50 /* Calculate which blocks of charge groups should be calculated,
51 * depending on processor number.
54 extern void print_nsb(FILE *fp,char *title,t_nsborder *nsb);
55 /* Print the values to file */
57 /*extern bool cg_avail(int icg,int jcg,t_nsborder *nsb);*/
58 /* Determine whether a charge group jcg is in the domain of icg:
59 * this is necessary for searching on a grid, to avoid double
60 * pairs of interactions.
63 /*extern int cg_index(int icg,t_nsborder *nsb);*/
64 /* Perform a modulo calculation giving the correct cg index */