# | Line 1 | Line 1 | |
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1 | + | /* |
2 | + | * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved. |
3 | + | * |
4 | + | * The University of Notre Dame grants you ("Licensee") a |
5 | + | * non-exclusive, royalty free, license to use, modify and |
6 | + | * redistribute this software in source and binary code form, provided |
7 | + | * that the following conditions are met: |
8 | + | * |
9 | + | * 1. Acknowledgement of the program authors must be made in any |
10 | + | * publication of scientific results based in part on use of the |
11 | + | * program. An acceptable form of acknowledgement is citation of |
12 | + | * the article in which the program was described (Matthew |
13 | + | * A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher |
14 | + | * J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented |
15 | + | * Parallel Simulation Engine for Molecular Dynamics," |
16 | + | * J. Comput. Chem. 26, pp. 252-271 (2005)) |
17 | + | * |
18 | + | * 2. Redistributions of source code must retain the above copyright |
19 | + | * notice, this list of conditions and the following disclaimer. |
20 | + | * |
21 | + | * 3. Redistributions in binary form must reproduce the above copyright |
22 | + | * notice, this list of conditions and the following disclaimer in the |
23 | + | * documentation and/or other materials provided with the |
24 | + | * distribution. |
25 | + | * |
26 | + | * This software is provided "AS IS," without a warranty of any |
27 | + | * kind. All express or implied conditions, representations and |
28 | + | * warranties, including any implied warranty of merchantability, |
29 | + | * fitness for a particular purpose or non-infringement, are hereby |
30 | + | * excluded. The University of Notre Dame and its licensors shall not |
31 | + | * be liable for any damages suffered by licensee as a result of |
32 | + | * using, modifying or distributing the software or its |
33 | + | * derivatives. In no event will the University of Notre Dame or its |
34 | + | * licensors be liable for any lost revenue, profit or data, or for |
35 | + | * direct, indirect, special, consequential, incidental or punitive |
36 | + | * damages, however caused and regardless of the theory of liability, |
37 | + | * arising out of the use of or inability to use software, even if the |
38 | + | * University of Notre Dame has been advised of the possibility of |
39 | + | * such damages. |
40 | + | */ |
41 | + | |
42 | #include <sys/time.h> | |
43 | #include <string.h> | |
44 | #include <stdio.h> | |
# | Line 26 | Line 67 | namespace mdProfileSpace { | |
67 | struct timeval startTime[N_PROFILES]; | |
68 | struct timeval endTime[N_PROFILES]; | |
69 | ||
70 | < | double accumTime[N_PROFILES]; |
70 | > | RealType accumTime[N_PROFILES]; |
71 | ||
72 | #ifdef IS_MPI | |
73 | < | double globalTime[N_PROFILES]; |
73 | > | RealType globalTime[N_PROFILES]; |
74 | #endif //is_mpi | |
75 | ||
76 | ||
# | Line 37 | Line 78 | extern "C"{ | |
78 | ||
79 | extern "C"{ | |
80 | ||
81 | < | void F90_FUNC(gettimes, GETTIMES)(double* forceTime, |
82 | < | double* commTime); |
81 | > | void FC_FUNC(gettimes, GETTIMES)(RealType* forceTime, |
82 | > | RealType* commTime); |
83 | } | |
84 | ||
85 | ||
# | Line 77 | Line 118 | void endProfile( proNames theProfile ){ | |
118 | ||
119 | void endProfile( proNames theProfile ){ | |
120 | struct timezone tz; | |
121 | < | double startVal, endVal; |
121 | > | RealType startVal, endVal; |
122 | ||
123 | gettimeofday( &endTime[theProfile], &tz ); | |
124 | ||
125 | < | startVal = (double)startTime[theProfile].tv_sec |
126 | < | + (double)startTime[theProfile].tv_usec / 1000000.0; |
125 | > | startVal = (RealType)startTime[theProfile].tv_sec |
126 | > | + (RealType)startTime[theProfile].tv_usec / 1000000.0; |
127 | ||
128 | < | endVal = (double)endTime[theProfile].tv_sec |
129 | < | + (double)endTime[theProfile].tv_usec / 1000000.0; |
128 | > | endVal = (RealType)endTime[theProfile].tv_sec |
129 | > | + (RealType)endTime[theProfile].tv_usec / 1000000.0; |
130 | ||
131 | accumTime[theProfile] += endVal - startVal; | |
132 | } | |
# | Line 94 | Line 135 | void writeProfiles( void ){ | |
135 | void writeProfiles( void ){ | |
136 | ||
137 | int i; | |
138 | < | double totalTime; |
139 | < | double percentTime[N_PROFILES]; |
138 | > | RealType totalTime; |
139 | > | RealType percentTime[N_PROFILES]; |
140 | int days, hours, minutes, secs, msecs; | |
141 | < | double donkey; |
141 | > | RealType donkey; |
142 | ||
143 | < | double forceTime, commTime; |
143 | > | RealType forceTime, commTime; |
144 | ||
145 | #ifdef IS_MPI | |
146 | int j; | |
147 | ||
148 | MPI_Status istatus; | |
149 | ||
150 | < | double nodeTime, nodeForceTime, nodeCommTime; |
151 | < | double nodeAccum[N_PROFILES]; |
152 | < | double nodePercent[N_PROFILES]; |
150 | > | RealType nodeTime, nodeForceTime, nodeCommTime; |
151 | > | RealType nodeAccum[N_PROFILES]; |
152 | > | RealType nodePercent[N_PROFILES]; |
153 | ||
154 | < | double globalTime, globalForceTime, globalCommTime; |
155 | < | double globalAccum[N_PROFILES]; |
156 | < | double globalPercent[N_PROFILES]; |
154 | > | RealType globalTime, globalForceTime, globalCommTime; |
155 | > | RealType globalAccum[N_PROFILES]; |
156 | > | RealType globalPercent[N_PROFILES]; |
157 | #endif // is_mpi | |
158 | ||
159 | ||
# | Line 150 | Line 191 | void writeProfiles( void ){ | |
191 | secs = (int)donkey; | |
192 | msecs = (int)( (donkey - secs) * 1000 ); | |
193 | ||
194 | < | F90_FUNC(gettimes, GETTIMES)(&forceTime, &commTime); |
194 | > | FC_FUNC(gettimes, GETTIMES)(&forceTime, &commTime); |
195 | ||
196 | fprintf( stdout, | |
197 | "----------------------------------------------------------------------------\n" | |
# | Line 170 | Line 211 | void writeProfiles( void ){ | |
211 | ||
212 | if( worldRank == 0 ){ | |
213 | ||
214 | < | double *nodeTots = new double[mpiSim->getNProcessors()]; |
215 | < | double *nodePercentTots = new double[mpiSim->getNProcessors()]; |
214 | > | RealType *nodeTots = new RealType[mpiSim->getNProcessors()]; |
215 | > | RealType *nodePercentTots = new RealType[mpiSim->getNProcessors()]; |
216 | ||
217 | totalTime = 0.0; | |
218 | for(i=0;i<N_PROFILES;i++) | |
# | Line 209 | Line 250 | void writeProfiles( void ){ | |
250 | secs = (int)donkey; | |
251 | msecs = (int)( (donkey - secs) * 1000 ); | |
252 | ||
253 | < | F90_FUNC(gettimes, GETTIMES)(&forceTime, &commTime); |
253 | > | FC_FUNC(gettimes, GETTIMES)(&forceTime, &commTime); |
254 | ||
255 | fprintf( stdout, | |
256 | "----------------------------------------------------------------------------\n" | |
# | Line 240 | Line 281 | void writeProfiles( void ){ | |
281 | ||
282 | nodeTime = 0.0; | |
283 | ||
284 | < | MPI_Recv(nodeAccum, N_PROFILES, MPI_DOUBLE, j, |
284 | > | MPI_Recv(nodeAccum, N_PROFILES, MPI_REALTYPE, j, |
285 | 1, MPI_COMM_WORLD, &istatus ); | |
286 | ||
287 | < | MPI_Recv(&nodeForceTime, 1, MPI_DOUBLE, j, |
287 | > | MPI_Recv(&nodeForceTime, 1, MPI_REALTYPE, j, |
288 | 1, MPI_COMM_WORLD, &istatus ); | |
289 | < | MPI_Recv(&nodeCommTime, 1, MPI_DOUBLE, j, |
289 | > | MPI_Recv(&nodeCommTime, 1, MPI_REALTYPE, j, |
290 | 1, MPI_COMM_WORLD, &istatus ); | |
291 | ||
292 | for(i=0;i<N_PROFILES;i++){ | |
# | Line 378 | Line 419 | void writeProfiles( void ){ | |
419 | ||
420 | if( worldRank == j ){ | |
421 | ||
422 | < | F90_FUNC(gettimes, GETTIMES)(&forceTime, &commTime); |
422 | > | FC_FUNC(gettimes, GETTIMES)(&forceTime, &commTime); |
423 | ||
424 | < | MPI_Send( accumTime, N_PROFILES, MPI_DOUBLE, 0, 1, MPI_COMM_WORLD ); |
425 | < | MPI_Send( &forceTime, 1, MPI_DOUBLE, 0, 1, MPI_COMM_WORLD ); |
426 | < | MPI_Send( &commTime, 1, MPI_DOUBLE, 0, 1, MPI_COMM_WORLD ); |
424 | > | MPI_Send( accumTime, N_PROFILES, MPI_REALTYPE, 0, 1, MPI_COMM_WORLD ); |
425 | > | MPI_Send( &forceTime, 1, MPI_REALTYPE, 0, 1, MPI_COMM_WORLD ); |
426 | > | MPI_Send( &commTime, 1, MPI_REALTYPE, 0, 1, MPI_COMM_WORLD ); |
427 | } | |
428 | } | |
429 | } |
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