More modular position handling.
[gromacs/qmmm-gamess-us.git] / include / gmx_wallcycle.h
blob965409682fbb0ff1ef4d4cc4c16a44fb25e84bd4
1 /*
2 *
3 * This source code is part of
4 *
5 * G R O M A C S
6 *
7 * GROningen MAchine for Chemical Simulations
8 *
9 * Written by David van der Spoel, Erik Lindahl, Berk Hess, and others.
10 * Copyright (c) 1991-2000, University of Groningen, The Netherlands.
11 * Copyright (c) 2001-2008, The GROMACS development team,
12 * check out http://www.gromacs.org for more information.
14 * This program is free software; you can redistribute it and/or
15 * modify it under the terms of the GNU General Public License
16 * as published by the Free Software Foundation; either version 2
17 * of the License, or (at your option) any later version.
19 * If you want to redistribute modifications, please consider that
20 * scientific software is very special. Version control is crucial -
21 * bugs must be traceable. We will be happy to consider code for
22 * inclusion in the official distribution, but derived work must not
23 * be called official GROMACS. Details are found in the README & COPYING
24 * files - if they are missing, get the official version at www.gromacs.org.
26 * To help us fund GROMACS development, we humbly ask that you cite
27 * the papers on the package - you can find them in the top README file.
29 * For more info, check our website at http://www.gromacs.org
31 * And Hey:
32 * Gallium Rubidium Oxygen Manganese Argon Carbon Silicon
36 #ifndef _gmx_wallcycle_h
37 #define _gmx_wallcycle_h
39 #include <stdio.h>
40 #include "typedefs.h"
42 enum { ewcRUN, ewcSTEP, ewcPPDURINGPME, ewcDOMDEC, ewcDDCOMMLOAD, ewcDDCOMMBOUND, ewcVSITECONSTR, ewcPP_PMESENDX, ewcMOVEX, ewcNS, ewcFORCE, ewcMOVEF, ewcPMEMESH, ewcPMEMESH_SEP, ewcPMEWAITCOMM, ewcPP_PMEWAITRECVF, ewcVSITESPREAD, ewcTRAJ, ewcUPDATE, ewcCONSTR, ewcMoveE, ewcTEST, ewcGB, ewcNR };
44 extern bool wallcycle_have_counter(void);
45 /* Returns if cycle counting is supported */
47 extern gmx_wallcycle_t wallcycle_init(FILE *fplog,int resetstep,t_commrec *cr);
48 /* Returns the wall cycle structure.
49 * Returns NULL when cycle counting is not supported.
52 extern void wallcycle_start(gmx_wallcycle_t wc, int ewc);
53 /* Set the start cycle count for ewc */
55 extern double wallcycle_stop(gmx_wallcycle_t wc, int ewc);
56 /* Stop the cycle count for ewc, returns the last cycle count */
58 extern void wallcycle_reset_all(gmx_wallcycle_t wc);
59 /* Resets all cycle counters to zero */
61 extern void wallcycle_sum(t_commrec *cr, gmx_wallcycle_t wc,double cycles[]);
62 /* Sum the cycles over the nodes in cr->mpi_comm_mysim */
64 extern void wallcycle_print(FILE *fplog, int nnodes, int npme, double realtime,
65 gmx_wallcycle_t wc, double cycles[]);
66 /* Print the cycle and time accounting */
68 extern gmx_large_int_t wcycle_get_reset_counters(gmx_wallcycle_t wc);
69 /* Return reset_counters from wc struct */
71 extern void wcycle_set_reset_counters(gmx_wallcycle_t wc, gmx_large_int_t reset_counters);
72 /* Set reset_counters */
74 #endif /* _gmx_wallcycle_h */