#include <thread_mpi.h>
#endif
+#ifdef HAVE_LIBMKL
+#include <mkl.h>
+#endif
+#ifdef GMX_GPU
+#include <cuda.h>
+#include <cuda_runtime_api.h>
+#endif
+#ifdef GMX_FFT_FFTW3
+#include <fftw3.h>
+#endif
+
/* This file is completely threadsafe - keep it that way! */
#include <string.h>
#include "copyrite.h"
#include "strdb.h"
#include "futil.h"
+#include "vec.h"
+#include "buildinfo.h"
+#include "gmx_cpuid.h"
static void pr_two(FILE *out,int c,int i)
{
static const char _gmx_ver_string[]="VERSION " VERSION;
#endif
-/* This routine only returns a static (constant) string, so we use a
- * mutex to initialize it. Since the string is only written to the
- * first time, there is no risk with multiple calls overwriting the
- * output for each other.
- */
const char *GromacsVersion()
{
return _gmx_ver_string;
}
-
void gmx_print_version_info(FILE *fp)
{
- fprintf(fp, "Version: %s\n", _gmx_ver_string);
+#ifdef GMX_GPU
+ int cuda_driver,cuda_runtime;
+#endif
+
+ fprintf(fp, "Gromacs version: %s\n", _gmx_ver_string);
#ifdef GMX_GIT_VERSION_INFO
- fprintf(fp, "GIT SHA1 hash: %s\n", _gmx_full_git_hash);
+ fprintf(fp, "GIT SHA1 hash: %s\n", _gmx_full_git_hash);
/* Only print out the branch information if present.
* The generating script checks whether the branch point actually
* coincides with the hash reported above, and produces an empty string
* in such cases. */
if (_gmx_central_base_hash[0] != 0)
{
- fprintf(fp, "Branched from: %s\n", _gmx_central_base_hash);
+ fprintf(fp, "Branched from: %s\n", _gmx_central_base_hash);
}
#endif
#ifdef GMX_DOUBLE
- fprintf(fp, "Precision: double\n");
+ fprintf(fp, "Precision: double\n");
#else
- fprintf(fp, "Precision: single\n");
+ fprintf(fp, "Precision: single\n");
#endif
#ifdef GMX_THREAD_MPI
- fprintf(fp, "Parallellization: thread_mpi\n");
+ fprintf(fp, "MPI library: thread_mpi\n");
#elif defined(GMX_MPI)
- fprintf(fp, "Parallellization: MPI\n");
+ fprintf(fp, "MPI library: MPI\n");
#else
- fprintf(fp, "Parallellization: none\n");
+ fprintf(fp, "MPI library: none\n");
#endif
-
+#ifdef GMX_OPENMP
+ fprintf(fp, "OpenMP support: enabled\n");
+#else
+ fprintf(fp, "OpenMP support: disabled\n");
+#endif
+#ifdef GMX_GPU
+ fprintf(fp, "GPU support: enabled\n");
+#else
+ fprintf(fp, "GPU support: disabled\n");
+#endif
+ /* A preprocessor trick to avoid duplicating logic from vec.h */
+#define gmx_stringify2(x) #x
+#define gmx_stringify(x) gmx_stringify2(x)
+ fprintf(fp, "invsqrt routine: %s\n", gmx_stringify(gmx_invsqrt(x)));
+ fprintf(fp, "CPU acceleration: %s\n", GMX_CPU_ACCELERATION_STRING);
+
+ /* TODO: Would be nicer to wrap this in a gmx_fft_version() call, but
+ * since that is currently in mdlib, can wait for master. */
#ifdef GMX_FFT_FFTPACK
- fprintf(fp, "FFT Library: fftpack\n");
+ fprintf(fp, "FFT library: fftpack (built-in)\n");
+#elif defined(GMX_FFT_FFTW3) && defined(GMX_NATIVE_WINDOWS)
+ fprintf(fp, "FFT library: %s\n", "fftw3");
+#elif defined(GMX_FFT_FFTW3) && defined(GMX_DOUBLE)
+ fprintf(fp, "FFT library: %s\n", fftw_version);
#elif defined(GMX_FFT_FFTW3)
- fprintf(fp, "FFT Library: fftw3\n");
+ fprintf(fp, "FFT library: %s\n", fftwf_version);
#elif defined(GMX_FFT_MKL)
- fprintf(fp, "FFT Library: MKL\n");
+ fprintf(fp, "FFT library: MKL\n");
+#else
+ fprintf(fp, "FFT library: unknown\n");
+#endif
+#ifdef GMX_LARGEFILES
+ fprintf(fp, "Large file support: enabled\n");
+#else
+ fprintf(fp, "Large file support: disabled\n");
+#endif
+#ifdef HAVE_RDTSCP
+ fprintf(fp, "RDTSCP usage: enabled\n");
#else
- fprintf(fp, "FFT Library: unknown\n");
+ fprintf(fp, "RDTSCP usage: disabled\n");
+#endif
+
+ fprintf(fp, "Built on: %s\n", BUILD_TIME);
+ fprintf(fp, "Built by: %s\n", BUILD_USER);
+ fprintf(fp, "Build OS/arch: %s\n", BUILD_HOST);
+ fprintf(fp, "Build CPU vendor: %s\n", BUILD_CPU_VENDOR);
+ fprintf(fp, "Build CPU brand: %s\n", BUILD_CPU_BRAND);
+ fprintf(fp, "Build CPU family: %d Model: %d Stepping: %d\n",
+ BUILD_CPU_FAMILY, BUILD_CPU_MODEL, BUILD_CPU_STEPPING);
+ /* TODO: The below strings can be quite long, so it would be nice to wrap
+ * them. Can wait for later, as the master branch has ready code to do all
+ * that. */
+ fprintf(fp, "Build CPU features: %s\n", BUILD_CPU_FEATURES);
+ fprintf(fp, "C compiler: %s\n", BUILD_C_COMPILER);
+ fprintf(fp, "C compiler flags: %s\n", BUILD_CFLAGS);
+ if (BUILD_CXX_COMPILER[0] != '\0')
+ {
+ fprintf(fp, "C++ compiler: %s\n", BUILD_CXX_COMPILER);
+ fprintf(fp, "C++ compiler flags: %s\n", BUILD_CXXFLAGS);
+ }
+#ifdef HAVE_LIBMKL
+ /* MKL might be used for LAPACK/BLAS even if FFTs use FFTW, so keep it separate */
+ fprintf(fp, "Linked with Intel MKL version %s.%s.%s.\n",
+ __INTEL_MKL__,__INTEL_MKL_MINOR__,__INTEL_MKL_UPDATE__);
+#endif
+#ifdef GMX_GPU
+ fprintf(fp, "CUDA compiler: %s\n",CUDA_NVCC_COMPILER_INFO);
+ cuda_driver = 0;
+ cudaDriverGetVersion(&cuda_driver);
+ cuda_runtime = 0;
+ cudaRuntimeGetVersion(&cuda_runtime);
+ fprintf(fp, "CUDA driver: %d.%d\n",cuda_driver/1000, cuda_driver%100);
+ fprintf(fp, "CUDA runtime: %d.%d\n",cuda_runtime/1000, cuda_runtime%100);
#endif
}
biod.pnpi.spb.ru / alexxy / gromacs.git / blobdiff