* Package: sci-chemistry/gromacs-4.5.5-r1  * Repository: gentoo  * Maintainer: sci-chemistry@gentoo.org  * USE: X amd64 blas consolekit double-precision elibc_glibc fftw kernel_linux lapack multilib policykit sse2 threads userland_GNU xml  * FEATURES: preserve-libs sandbox >>> Unpacking source... >>> Unpacking gromacs-4.5.5.tar.gz to /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work >>> Unpacking 0001-Make-stack-non-executable-for-GAS-assembly.patch.gz to /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work >>> Unpacking 0002-Make-stack-non-executable-for-ATT-assembly.patch.gz to /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work >>> Source unpacked in /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work >>> Preparing source in /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5 ... * Applying 0001-Make-stack-non-executable-for-GAS-assembly.patch ...  [ ok ] * Applying 0002-Make-stack-non-executable-for-ATT-assembly.patch ...  [ ok ] * Applying gromacs-4.5.5-cmake-cpp-asm.patch ...  [ ok ] * Applying gromacs-4.5.5-enable-see.patch ...  [ ok ] >>> Source prepared. >>> Configuring source in /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5 ... * * For most simulations single precision is accurate enough. In some * cases double precision is required to get reasonable results: * * -normal mode analysis, for the conjugate gradient or l-bfgs minimization * and the calculation and diagonalization of the Hessian * -calculation of the constraint force between two large groups of atoms * -energy conservation: this can only be done without temperature coupling and * without cutoffs * * Configuring for double precision удалён «/var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/cmake/FindBLAS.cmake» удалён «/var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/cmake/FindLAPACK.cmake» >>> Working in BUILD_DIR: "/var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5_double" cmake --no-warn-unused-cli -C /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/temp/gentoo_common_config.cmake -DCMAKE_INSTALL_PREFIX=/usr -DGMX_FFT_LIBRARY=fftw3 -DGMX_X11=ON -DGMX_EXTERNAL_BLAS=ON -DGMX_GSL=OFF -DGMX_EXTERNAL_LAPACK=ON -DGMX_THREADS=ON -DGMX_XML=ON -DGMX_DEFAULT_SUFFIX=off -DGMX_ACCELERATION=sse -DGMXLIB=lib64 -DGMX_DOUBLE=ON -DGMX_MPI=OFF -DGMX_BINARY_SUFFIX= -DGMX_LIBS_SUFFIX= -DCMAKE_BUILD_TYPE=Gentoo -DCMAKE_INSTALL_DO_STRIP=OFF -DCMAKE_USER_MAKE_RULES_OVERRIDE=/var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/temp/gentoo_rules.cmake /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5 Not searching for unused variables given on the command line. loading initial cache file /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/temp/gentoo_common_config.cmake -- The C compiler identification is GNU -- The CXX compiler identification is GNU -- Check for working C compiler: /usr/bin/x86_64-pc-linux-gnu-gcc -- Check for working C compiler: /usr/bin/x86_64-pc-linux-gnu-gcc -- works -- Detecting C compiler ABI info -- Detecting C compiler ABI info - done -- Check for working CXX compiler: /usr/bin/x86_64-pc-linux-gnu-g++ -- Check for working CXX compiler: /usr/bin/x86_64-pc-linux-gnu-g++ -- works -- Detecting CXX compiler ABI info -- Detecting CXX compiler ABI info - done -- Performing Test CFLAGS_WARN -- Performing Test CFLAGS_WARN - Success -- Performing Test CFLAGS_EXCESS_PREC -- Performing Test CFLAGS_EXCESS_PREC - Success -- Performing Test CFLAGS_COPT -- Performing Test CFLAGS_COPT - Success -- Performing Test CFLAGS_NOINLINE -- Performing Test CFLAGS_NOINLINE - Success -- Performing Test CXXFLAGS_WARN -- Performing Test CXXFLAGS_WARN - Success -- Performing Test CXXFLAGS_EXCESS_PREC -- Performing Test CXXFLAGS_EXCESS_PREC - Success -- Performing Test CXXFLAGS_COPT -- Performing Test CXXFLAGS_COPT - Success -- Performing Test CXXFLAGS_NOINLINE -- Performing Test CXXFLAGS_NOINLINE - Success -- Using manually set binary suffix: "" -- Using manually set library suffix: "" -- Looking for include files HAVE_STRING_H -- Looking for include files HAVE_STRING_H - found -- Looking for include files HAVE_MATH_H -- Looking for include files HAVE_MATH_H - found -- Looking for include files HAVE_LIMITS_H -- Looking for include files HAVE_LIMITS_H - found -- Looking for include files HAVE_MEMORY_H -- Looking for include files HAVE_MEMORY_H - found -- Looking for include files HAVE_UNISTD_H -- Looking for include files HAVE_UNISTD_H - found -- Looking for include files HAVE_DIRECT_H -- Looking for include files HAVE_DIRECT_H - not found. -- Looking for include files HAVE_PWD_H -- Looking for include files HAVE_PWD_H - found -- Looking for include files HAVE_STDINT_H -- Looking for include files HAVE_STDINT_H - found -- Looking for include files HAVE_STDLIB_H -- Looking for include files HAVE_STDLIB_H - found -- Looking for include files HAVE_PTHREAD_H -- Looking for include files HAVE_PTHREAD_H - found -- Looking for include files HAVE_DIRENT_H -- Looking for include files HAVE_DIRENT_H - found -- Looking for include files HAVE_INTTYPES_H -- Looking for include files HAVE_INTTYPES_H - found -- Looking for include files HAVE_REGEX_H -- Looking for include files HAVE_REGEX_H - found -- Looking for include files HAVE_SYS_TYPES_H -- Looking for include files HAVE_SYS_TYPES_H - found -- Looking for include files HAVE_SYS_STAT_H -- Looking for include files HAVE_SYS_STAT_H - found -- Looking for include files HAVE_SYS_TIME_H -- Looking for include files HAVE_SYS_TIME_H - found -- Looking for include files HAVE_RPC_RPC_H -- Looking for include files HAVE_RPC_RPC_H - found -- Looking for include files HAVE_RPC_XDR_H -- Looking for include files HAVE_RPC_XDR_H - found -- Looking for include files HAVE_XMMINTRIN_H -- Looking for include files HAVE_XMMINTRIN_H - found -- Looking for include files HAVE_EMMINTRIN_H -- Looking for include files HAVE_EMMINTRIN_H - found -- Looking for include files HAVE_PMMINTRIN_H -- Looking for include files HAVE_PMMINTRIN_H - found -- Looking for include files HAVE_SMMINTRIN_H -- Looking for include files HAVE_SMMINTRIN_H - found -- Looking for include files HAVE_IO_H -- Looking for include files HAVE_IO_H - not found. -- Looking for strcasecmp -- Looking for strcasecmp - found -- Looking for strdup -- Looking for strdup - found -- Looking for vprintf -- Looking for vprintf - found -- Looking for memcmp -- Looking for memcmp - found -- Looking for posix_memalign -- Looking for posix_memalign - found -- Looking for memalign -- Looking for memalign - found -- Looking for _aligned_malloc -- Looking for _aligned_malloc - not found -- Looking for gettimeofday -- Looking for gettimeofday - found -- Looking for isnan -- Looking for isnan - found -- Looking for _isnan -- Looking for _isnan - not found -- Looking for isfinite -- Looking for isfinite - not found -- Looking for _isfinite -- Looking for _isfinite - not found -- Looking for fsync -- Looking for fsync - found -- Looking for _fileno -- Looking for _fileno - not found -- Looking for fileno -- Looking for fileno - found -- Looking for _commit -- Looking for _commit - not found -- Looking for sqrt in m -- Looking for sqrt in m - found -- Looking for cbrt in m -- Looking for cbrt in m - found -- Looking for stddef.h -- Looking for stddef.h - found -- Check size of bool -- Check size of bool - failed -- Check size of int -- Check size of int - done -- Check size of long int -- Check size of long int - done -- Check size of long long int -- Check size of long long int - done -- Check size of off_t -- Check size of off_t - done -- Check size of void * -- Check size of void * - done -- Check size of uid_t -- Check size of uid_t - done -- Check size of gid_t -- Check size of gid_t - done -- Check size of size_t -- Check size of size_t - done -- Check size of off_t -- Check size of off_t - done -- Check if the system is big endian -- Searching 16 bit integer -- Check size of unsigned short -- Check size of unsigned short - done -- Using unsigned short -- Check if the system is big endian - little endian -- checking for module 'libxml-2.0' -- found libxml-2.0, version 2.7.8 -- Found LibXml2: /usr/lib64/libxml2.so -- Looking for XOpenDisplay in /usr/lib64/libX11.so;/usr/lib64/libXext.so -- Looking for XOpenDisplay in /usr/lib64/libX11.so;/usr/lib64/libXext.so - found -- Looking for gethostbyname -- Looking for gethostbyname - found -- Looking for connect -- Looking for connect - found -- Looking for remove -- Looking for remove - found -- Looking for shmat -- Looking for shmat - found -- Looking for IceConnectionNumber in ICE -- Looking for IceConnectionNumber in ICE - found -- Found X11: /usr/lib64/libX11.so -- Looking for include files CMAKE_HAVE_PTHREAD_H -- Looking for include files CMAKE_HAVE_PTHREAD_H - found -- Looking for pthread_create in pthreads -- Looking for pthread_create in pthreads - not found -- Looking for pthread_create in pthread -- Looking for pthread_create in pthread - found -- Found Threads: TRUE -- Performing Test PTHREAD_SETAFFINITY -- Performing Test PTHREAD_SETAFFINITY - Success -- Looking for include files HAVE_SCHED_H -- Looking for include files HAVE_SCHED_H - found -- Looking for sysconf -- Looking for sysconf - found -- Atomics found -- Setting build user & time -- Setting build user & time - OK -- Checking floating point format -- Checking floating point format - unknown -- Checking for 64-bit off_t -- Checking for 64-bit off_t - present -- Checking for fseeko/ftello -- Checking for fseeko/ftello - present -- Checking for return type of signals -- Checking for return type of signals - void -- Checking for SIGUSR1 -- Checking for SIGUSR1 - found -- Checking for inline keyword -- Checking for inline keyword - inline -- Checking for inline keyword -- Checking for inline keyword - inline -- Checking for pipe support -- Checking for GCC x86 inline asm -- Checking for GCC x86 inline asm - supported -- Checking for MSVC x86 inline asm -- Checking for MSVC x86 inline asm - not supported -- Checking for system XDR support -- Checking for system XDR support - present -- Found FFTW3: /usr/lib64/libfftw3.so -- The Fortran compiler identification is GNU -- Check for working Fortran compiler: /usr/bin/gfortran -- Check for working Fortran compiler: /usr/bin/gfortran -- works -- Detecting Fortran compiler ABI info -- Detecting Fortran compiler ABI info - done -- Checking whether /usr/bin/gfortran supports Fortran 90 -- Checking whether /usr/bin/gfortran supports Fortran 90 -- yes -- checking for module 'blas' -- found blas, version 5.1.0 -- checking for module 'lapack' -- found lapack, version 5.1.0 -- The ASM-ATT compiler identification is GNU -- Found assembler: /usr/bin/as -- <<< Gentoo configuration >>> Build type Gentoo Install path /usr Compiler flags: C -O2 -pipe -march=native -mtune=native C++ -O2 -pipe -march=native -mtune=native Linker flags: Executable -Wl,-O1 -Wl,--as-needed,--hash-style=gnu,--sort-common Module -Wl,-O1 -Wl,--as-needed,--hash-style=gnu,--sort-common Shared -Wl,-O1 -Wl,--as-needed,--hash-style=gnu,--sort-common -- Configuring done -- Generating done -- Build files have been written to: 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src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/alltoall.c.o [ 41%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/barrier.c.o Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/p2p_protocol.c.o [ 41%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/p2p_send_recv.c.o [ 41%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/bcast.c.o [ 41%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/p2p_wait.c.o [ 42%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/collective.c.o Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/profile.c.o [ 42%] /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/alltoall.c: В функции «tMPI_Alltoall»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/alltoall.c:74:25: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/p2p_send_recv.c: В функции «tMPI_Send»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/p2p_send_recv.c:69:25: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/bcast.c: В функции «tMPI_Bcast»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/bcast.c:68:25: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 [ 42%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/comm.c.o [ 42%] /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/p2p_wait.c: В функции «tMPI_Wait»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/p2p_wait.c:65:25: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/pthreads.c.o Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/errhandler.c.o [ 42%] [ 42%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/event.c.o [ 42%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/reduce.c.o /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/pthreads.c: В функции «tMPI_Thread_setspecific»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/pthreads.c:431:5: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/reduce_fast.c.o [ 43%] [ 43%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/gather.c.o Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/scatter.c.o [ 43%] [ 43%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/group.c.o Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/tmpi_init.c.o [ 43%] /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/reduce.c: В функции «tMPI_Reduce_fast»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/reduce.c:87:25: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/comm.c: В функции «tMPI_Comm_split»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/comm.c:428:42: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/topology.c.o [ 43%] /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/scatter.c: В функции «tMPI_Scatter»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/scatter.c:70:25: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/gather.c: В функции «tMPI_Gather»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/gather.c:69:25: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/list.c.o [ 44%] [ 44%] [ 44%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/type.c.o Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/lock.c.o /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/group.c: В функции «tMPI_In_group»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/group.c:68:8: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/numa_malloc.c.o /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/tmpi_init.c: В функции «tMPI_Thread_init»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/tmpi_init.c:269:28: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 [ 44%] Building C object src/gmxlib/CMakeFiles/gmx.dir/thread_mpi/once.c.o /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/topology.c: В функции «tMPI_Cart_get»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/topology.c:105:42: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/once.c: В функции «tMPI_Once»: /var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5/src/gmxlib/thread_mpi/once.c:75:38: замечание: The ABI for passing parameters with 64-byte alignment has changed in GCC 4.6 Linking C shared library libgmx.so /usr/lib/gcc/x86_64-pc-linux-gnu/4.6.2/../../../../x86_64-pc-linux-gnu/bin/ld: cannot find -lacml /usr/lib/gcc/x86_64-pc-linux-gnu/4.6.2/../../../../x86_64-pc-linux-gnu/bin/ld: cannot find -lacml collect2: выполнение ld завершилось с кодом возврата 1 make[2]: *** [src/gmxlib/libgmx.so.6] Ошибка 1 make[1]: *** [src/gmxlib/CMakeFiles/gmx.dir/all] Ошибка 2 make: *** [all] Ошибка 2 * ERROR: sci-chemistry/gromacs-4.5.5-r1 failed (compile phase): * emake failed * * If you need support, post the output of 'emerge --info =sci-chemistry/gromacs-4.5.5-r1', * the complete build log and the output of 'emerge -pqv =sci-chemistry/gromacs-4.5.5-r1'. * The complete build log is located at '/var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/temp/build.log'. * The ebuild environment file is located at '/var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/temp/environment'. * S: '/var/tmp/portage/sci-chemistry/gromacs-4.5.5-r1/work/gromacs-4.5.5'