Merge branch 'master' of git.gromacs.org:gromacs
[gromacs/AngularHB.git] / include / mpelogging.h
blob5a5bea6c1db947ab9fa7c0c6e7f2a30440729bbb
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 -
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22 * inclusion in the official distribution, but derived work must not
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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.
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31 * And Hey:
32 * Gallium Rubidium Oxygen Manganese Argon Carbon Silicon
36 #ifdef __cplusplus
37 extern "C" {
38 #endif
40 /* define USE_MPE if you want MPE logging
42 * you then need to link with the appropriate libraries
43 * that come with the mpich distribution (can be found in the
44 * mpe subdirectory */
45 /* #define USE_MPE */
47 /* define BARRIERS if you want to have extra MPI_Barriers
48 * in the code which might help analyzing the MPE logfiles
50 /* #define BARRIERS */
51 #ifdef BARRIERS
52 #define GMX_BARRIER(communicator) MPI_Barrier(communicator)
53 #else
54 #define GMX_BARRIER(communicator)
55 #endif
57 #ifdef USE_MPE
58 #define GMX_MPE_LOG(event) MPE_Log_event(event, 0, "")
59 #else
60 #define GMX_MPE_LOG(event)
61 #endif
63 #ifdef USE_MPE
64 #include <mpe.h>
65 /* Define MPE logging events here */
66 /* General events */
67 int ev_timestep1, ev_timestep2;
68 int ev_ns_start, ev_ns_finish;
69 int ev_calc_bonds_start, ev_calc_bonds_finish;
70 int ev_send_coordinates_start, ev_send_coordinates_finish;
71 int ev_update_fr_start, ev_update_fr_finish;
72 int ev_clear_rvecs_start, ev_clear_rvecs_finish;
73 int ev_output_start, ev_output_finish;
74 int ev_update_start, ev_update_finish;
75 int ev_force_start, ev_force_finish;
76 int ev_do_fnbf_start, ev_do_fnbf_finish;
78 /* Shift related events*/
79 int ev_shift_start, ev_shift_finish;
80 int ev_unshift_start, ev_unshift_finish;
81 int ev_mk_mshift_start, ev_mk_mshift_finish;
83 /* PME related events */
84 int ev_pme_start, ev_pme_finish;
85 int ev_spread_on_grid_start, ev_spread_on_grid_finish;
86 int ev_sum_qgrid_start, ev_sum_qgrid_finish;
87 int ev_gmxfft3d_start, ev_gmxfft3d_finish;
88 int ev_solve_pme_start, ev_solve_pme_finish;
89 int ev_gather_f_bsplines_start, ev_gather_f_bsplines_finish;
90 int ev_reduce_start, ev_reduce_finish;
91 int ev_rscatter_start, ev_rscatter_finish;
92 int ev_alltoall_start, ev_alltoall_finish;
93 int ev_pmeredist_start, ev_pmeredist_finish;
94 int ev_init_pme_start, ev_init_pme_finish;
95 int ev_global_stat_start, ev_global_stat_finish;
96 int ev_sum_lrforces_start, ev_sum_lrforces_finish;
97 int ev_virial_start, ev_virial_finish;
98 int ev_sort_start, ev_sort_finish;
99 int ev_sum_qgrid_start, ev_sum_qgrid_finish;
101 /* Essential dynamics related events */
102 int ev_edsam_start, ev_edsam_finish;
103 int ev_get_group_x_start, ev_get_group_x_finish;
104 int ev_ed_apply_cons_start, ev_ed_apply_cons_finish;
105 int ev_fit_to_reference_start, ev_fit_to_reference_finish;
106 #endif
108 #ifdef __cplusplus
110 #endif