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Functions
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Description

This file declares functions for domdec to use while managing inter-atomic constraints.

Author
Berk Hess hess@.nosp@m.kth..nosp@m.se

Functions

void dd_clear_local_constraint_indices (gmx_domdec_t *dd)
 Clears the local indices for the constraint communication setup.
 
int dd_make_local_constraints (struct gmx_domdec_t *dd, int at_start, const struct gmx_mtop_t *mtop, const int *cginfo, gmx::Constraints *constr, int nrec, struct t_ilist *il_local)
 Sets up communication and atom indices for all local+connected constraints.
 
void init_domdec_constraints (gmx_domdec_t *dd, const gmx_mtop_t *mtop)
 Initializes the data structures for constraint communication.