/dports/science/gromacs/gromacs-2021.4/src/gromacs/utility/ |
H A D | gmxomp.cpp | 113 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_omp_check_thread_affinity() 131 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_omp_check_thread_affinity() 154 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in gmx_omp_check_thread_affinity()
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H A D | futil.cpp | 500 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in findLibraryFile() 517 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in openLibraryFile()
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/dports/science/gromacs/gromacs-2021.4/src/testutils/ |
H A D | mpitest.cpp | 87 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in threadStartFunc() 131 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in threadMpiTestRunner()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/fileio/ |
H A D | oenv.cpp | 119 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in output_env_init() 129 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in output_env_init_default() 210 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in output_env_get_program_display_name()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/modularsimulator/ |
H A D | propagator.cpp | 170 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in run() 228 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in run() 289 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in run() 350 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in run()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/mdrunutility/ |
H A D | logging.cpp | 74 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in prepareLogFile()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/nbnxm/opencl/ |
H A D | nbnxm_ocl_jit_support.cpp | 219 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in nbnxn_gpu_compile_kernels()
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/dports/science/plumed/plumed2-2.7.2/patches/gromacs-2019.6.diff/src/gromacs/mdrun/ |
H A D | runner.cpp | 221 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in mdrunner_start_fn() 468 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in mdrunner() 475 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in mdrunner() 629 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in mdrunner() 719 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in mdrunner() 1073 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in mdrunner() 1336 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in mdrunner()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/ewald/ |
H A D | pme.cpp | 380 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in PmeAtomComm() 953 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_pme_reinit() 1273 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_pme_do() 1306 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_pme_do() 1450 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_pme_do() 1476 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_pme_do() 1525 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_pme_do() 1551 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_pme_do()
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H A D | pme_gpu_program_impl_ocl.cpp | 172 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR; in compileKernels()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/correlationfunctions/ |
H A D | manyautocorrelation.cpp | 122 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in many_auto_correl()
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H A D | crosscorr.cpp | 154 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in many_cross_corr()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/gpu_utils/ |
H A D | device_stream_manager.cpp | 125 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in Impl()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/gmxpreprocess/ |
H A D | fflibutil.cpp | 120 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in fflib_search_file_end()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/listed_forces/ |
H A D | manage_threading.cpp | 431 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in setup_bonded_threading() 519 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in bonded_threading_t()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/gmxana/ |
H A D | nsfactor.cpp | 273 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in calc_radial_distribution_histogram() 331 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in calc_radial_distribution_histogram()
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H A D | gmx_hbond.cpp | 525 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in add_hbond() 2942 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 2965 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 2998 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 3125 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 3148 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 3163 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 3175 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 3185 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() 3215 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in gmx_hbond() [all …]
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/dports/science/plumed/plumed2-2.7.2/patches/gromacs-2020.6.diff/src/gromacs/mdrun/ |
H A D | runner.cpp | 366 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner_start_fn() 721 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 804 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 877 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 1185 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 1471 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/pulling/ |
H A D | output.cpp | 522 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in init_pull_output_files() 535 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in init_pull_output_files()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/nbnxm/ |
H A D | kerneldispatch.cpp | 515 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in dispatchFreeEnergyKernel() 558 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in dispatchFreeEnergyKernel()
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H A D | gridset.cpp | 218 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in putOnGrid()
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H A D | atomdata.cpp | 1071 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in nbnxn_atomdata_copy_x_to_nbat_x() 1370 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in nbnxn_atomdata_add_nbat_f_to_f_treereduce() 1419 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in nbnxn_atomdata_add_nbat_f_to_f_stdreduce() 1467 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in reduceForces()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/mdrun/ |
H A D | runner.cpp | 382 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner_start_fn() 747 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 821 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 900 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 1264 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 1616 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner()
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/dports/science/plumed/plumed2-2.7.2/patches/gromacs-2021.diff/src/gromacs/mdrun/ |
H A D | runner.cpp | 392 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner_start_fn() 757 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 831 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 910 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 1260 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner() 1612 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR in mdrunner()
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/fft/ |
H A D | fft_fftw3.cpp | 65 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR 71 GMX_CATCH_ALL_AND_EXIT_WITH_FATAL_ERROR
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