source: ThirdParty/mpqc_open/src/lib/util/group/memmtmpi.h@ 482400e

Action_Thermostats Add_AtomRandomPerturbation Add_RotateAroundBondAction Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_ChronosMutex Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion GeometryObjects Gui_displays_atomic_force_velocity IndependentFragmentGrids_IntegrationTest JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks RotateToPrincipalAxisSystem_UndoRedo StoppableMakroAction Subpackage_levmar Subpackage_vmg ThirdParty_MPQC_rebuilt_buildsystem TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps Ubuntu_1604_changes stable
Last change on this file since 482400e was 860145, checked in by Frederik Heber <heber@…>, 8 years ago

Merge commit '0b990dfaa8c6007a996d030163a25f7f5fc8a7e7' as 'ThirdParty/mpqc_open'

  • Property mode set to 100644
File size: 3.0 KB
Line 
1//
2// memmtmpi.h
3// based on memmpi.h
4//
5// Copyright (C) 1996 Limit Point Systems, Inc.
6//
7// Author: Curtis Janssen <cljanss@limitpt.com>
8// Maintainer: LPS
9//
10// This file is part of the SC Toolkit.
11//
12// The SC Toolkit is free software; you can redistribute it and/or modify
13// it under the terms of the GNU Library General Public License as published by
14// the Free Software Foundation; either version 2, or (at your option)
15// any later version.
16//
17// The SC Toolkit is distributed in the hope that it will be useful,
18// but WITHOUT ANY WARRANTY; without even the implied warranty of
19// MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
20// GNU Library General Public License for more details.
21//
22// You should have received a copy of the GNU Library General Public License
23// along with the SC Toolkit; see the file COPYING.LIB. If not, write to
24// the Free Software Foundation, 675 Mass Ave, Cambridge, MA 02139, USA.
25//
26// The U.S. Government is granted a limited license as per AL 91-7.
27//
28
29#ifdef __GNUC__
30#pragma interface
31#endif
32
33#ifndef _util_group_memmtmpi_h
34#define _util_group_memmtmpi_h
35
36#include <fstream>
37#define MPICH_SKIP_MPICXX
38#include <mpi.h>
39
40#include <util/group/message.h>
41#include <util/group/memamsg.h>
42#include <util/group/thread.h>
43
44namespace sc {
45
46class MTMPIThread;
47
48/** This MemoryGrp class requires a MT-safe MPI implementation. The
49default MessageGrp must be a MPIMessageGrp. MPI must be safe with respect
50to the default ThreadGrp. Alternately, a MessageGrp and a ThreadGrp can be
51passed to the constructor. */
52class MTMPIMemoryGrp: public ActiveMsgMemoryGrp {
53 private:
54 Ref<ThreadGrp> th_;
55
56 Ref<ThreadLock> serial_lock_;
57 int serial_;
58 int serial(int node);
59
60 MPI_Comm comp_comm_;
61 MPI_Comm comm_comm_;
62 int req_tag_;
63
64 int active_;
65
66 unsigned int *nreq_sent_;
67 unsigned int *nreq_sent_buf_;
68
69 MTMPIThread **thread_;
70 Ref<ThreadLock> print_lock_; // needed for debugging only
71 std::ofstream hout; // handler out
72 std::ofstream mout; // main thread out
73
74 void init_mtmpimg(MPI_Comm comm, int nthreads);
75
76 // parent class pure virtuals
77 void retrieve_data(void *, int node, int offset, int size, int lock);
78 void replace_data(void *, int node, int offset, int size, int unlock);
79 void sum_data(double *data, int node, int doffset, int dsize);
80
81 friend class MTMPIThread;
82 public:
83 /** Construct a MTMPIMemoryGrp given a MessageGrp, ThreadGrp, and
84 an MPI communicator. The communicator can be a subset of
85 MPI_COMM_WORLD, in which case, the MessageGrp must refer to the
86 same subset. */
87 MTMPIMemoryGrp(const Ref<MessageGrp>& msg, const Ref<ThreadGrp> &th,
88 MPI_Comm comm = MPI_COMM_WORLD);
89 /** Construct a MTMPIMemoryGrp given a KeyVal input object. A
90 fully thread safe MPI is needed (MPI_THREAD_MULTIPLE). */
91 MTMPIMemoryGrp(const Ref<KeyVal> &);
92 ~MTMPIMemoryGrp();
93
94 void activate();
95 void deactivate();
96
97 void sync();
98};
99
100}
101
102#endif
103
104// Local Variables:
105// mode: c++
106// c-file-style: "CLJ"
107// End:
Note: See TracBrowser for help on using the repository browser.