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unset MPI detection leftover cache variables
[alexxy/gromacs.git]
/
CMakeLists.txt
2012-11-20
Christoph Junghans
Merge "Fix g_msd -mol" into release-4-6
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2012-11-20
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-11-19
Roland Schulz
Merge changes Ibc555d88,Iaf6f3051 into release-4-6
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2012-11-19
Mark Abraham
Merge "SSE4.1 single-precision kernels" into release-4-6
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2012-11-19
Mark Abraham
Minor updates to CMake usage
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2012-11-19
Roland Schulz
Add CMAKE_PREFIX_PATH to cmake-gui
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2012-11-19
Roland Schulz
Merge "Remove double declaration in headers" into relea...
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2012-11-19
Szilard Pall
always mark as advanced leftover FindCUDA variables
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2012-11-17
Roland Schulz
Rename remaining GMX_ACCELERATION to GMX_CPU_ACCELERATION
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2012-11-17
David van der Spoel
Merge "Added grompp warning" into release-4-6
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2012-11-17
David van der Spoel
Merge "Remove rest of the xml support" into release-4-6
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2012-11-17
Roland Schulz
Merge "Removing Zn and Ar non-OPLS atom types" into...
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2012-11-16
Christoph Junghans
Remove rest of the xml support
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2012-11-16
David van der Spoel
Merge "Removes unused files" into release-4-6
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2012-11-16
Erik Lindahl
SSE2 single-precision kernels
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2012-11-15
Christoph Junghans
Merge "Test that compiling and linking of AVX works...
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2012-11-12
Roland Schulz
Test that compiling and linking of AVX works
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2012-11-12
Roland Schulz
Allow to disable usage of rdtscp
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2012-11-12
Roland Schulz
Merge "Backport ThreadMPI.cmake version from master...
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2012-11-12
Roland Schulz
Backport ThreadMPI.cmake version from master
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2012-11-11
Roland Schulz
Fix FMA4 compile for GCC and MSVC
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2012-11-09
Kasson
Merge "only use CPU_COUNT if it's available" into relea...
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2012-11-09
Szilard Pall
also preferentiate .lib with GMX_PREFER_STATIC_LIBS
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2012-11-08
Christoph Junghans
Merge "auto-set nvcc host compiler with FindMPI detecti...
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2012-11-08
Erik Lindahl
Infrastructure for new group kernels, and new C kernels
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2012-11-07
Szilard Pall
detect externally set CPU affinity
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2012-11-06
Roland Schulz
Fix cmake error if compiler starts with blank line
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2012-11-06
Berk Hess
Merge "Add option to install libcudart" into release-4-6
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2012-11-06
Berk Hess
Merge "don't execute any mpi_info/mpiname in the path...
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2012-11-05
Berk Hess
Merge "updated several things related with OpenMP threa...
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2012-11-03
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-11-03
Christoph Junghans
Reworked version of cmake FFTW detection
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2012-11-02
Roland Schulz
Merge all License/COPYING files into one and install it
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2012-11-01
Roland Schulz
Fix DEB/RPM cpack generation
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2012-11-01
Christoph Junghans
Actually disable GPU when compiling in double
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2012-10-30
Roland Schulz
Fix that no OpenMP flags are used with GMX_OPENMP=no
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2012-10-27
Roland Schulz
Set HAVE_FSEEKO consistently in one place
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2012-10-26
Roland Schulz
Merge "fixed incorrect PME load balancing limitation...
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2012-10-26
Christoph Junghans
Merge "enable GMX_PREFER_STATIC_LIBS CMake option on...
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2012-10-24
Szilárd Páll
enable GMX_PREFER_STATIC_LIBS CMake option on Mac OS X
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2012-10-18
Roland Schulz
Merge "Added thread affinity API to thread_mpi." into...
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2012-10-17
Kasson
Merge "Make Gromacs compile without C++ compiler" into...
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2012-10-10
Roland Schulz
Make Gromacs compile without C++ compiler
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2012-10-03
Sander Pronk
Added two #defines that state the gromacs API + program...
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2012-10-02
Szilard Pall
added Verlet scheme and NxN non-bonded functionality
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2012-10-01
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-09-24
Kasson
Merge "Fixed segfault with FE code for older tpr files...
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2012-09-12
Mark Abraham
Merge "Don't fail linking if man page building fails...
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2012-09-10
Roland Schulz
Merge "Update use of CPack components and add install...
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2012-09-03
Szilard Pall
Merge branch 'release-4-5-patches' into release-4-6
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2012-08-31
Mark Abraham
Update use of CPack components and add install targets
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2012-08-20
Christoph Junghans
Merge "Fixing of things associated with aminoacid.rtp...
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2012-08-11
Roland Schulz
Make GCC OpenMP libraries static if GMX_PREFER_STATIC_O...
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2012-08-11
Roland Schulz
Guarantee OpenMP flags for linker and make them user...
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2012-07-26
Roland Schulz
Fix that VMD version check was performed for binary...
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2012-07-25
Roland Schulz
Merge "cmake: allow switch between single and double...
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2012-07-25
Roland Schulz
Merge "fix a segfault in sse_mask_init" into release-4-6
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2012-07-24
Roland Schulz
Fix installation rules for man pages: don't install...
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2012-07-24
Roland Schulz
Add default root folder to cpack archives
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2012-07-16
Christoph Junghans
Merge "Enforced rotation: PBC/restart fix" into release-4-6
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2012-07-15
David van der Spoel
Merge "Autogenerate gromacs.7 from programs.txt" into...
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2012-07-13
Roland Schulz
Merge release-4.5-patches into HEAD
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2012-07-10
Roland Schulz
Use relative rpath to support relocatable binary packages
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2012-07-10
Roland Schulz
Allow usage of relative install paths
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2012-07-06
Roland Schulz
Don't prevent GMX_PREFER_STATIC_LIBS with BUILD_SHARED_LIBS
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2012-07-05
Roland Schulz
Build man-pages instead of distributing them in the...
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2012-07-05
Christoph Junghans
Merge "Don't rerun checks and be quiet 2nd time cmake...
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2012-07-05
Roland Schulz
Don't rerun checks and be quiet 2nd time cmake is run
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2012-06-26
Roland Schulz
Merge "Fix gmx_fatal for serial compilation" into relea...
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2012-06-25
Szilard Pall
introduce gmx_omp wrapper for the OpenMP API
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2012-06-24
Michael Shirts
Merge "Fix mdp_opt formatting of expanded ensemble...
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2012-06-22
Christoph Junghans
Merge "Simple patch for openmm_wrapper.cpp" into releas...
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2012-06-19
Mark Abraham
Merge "Fixes #882 - looping bug in trxio.c" into relea...
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2012-06-19
Christoph Junghans
Merge "Quiet linker on BlueGene" into release-4-5-patches
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2012-06-18
Christoph Junghans
Merge "Fix g_lie counting last frame twice" into releas...
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2012-06-16
Erik Lindahl
New CPU detection & AVX/SSE code, removed raw assembly...
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2012-06-15
Mark Abraham
Quiet linker on BlueGene
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2012-06-15
Christoph Junghans
Merge "Work around failure of endianness testing on...
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2012-06-06
Mark Abraham
Work around failure of endianness testing on BlueGene
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2012-06-01
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-06-01
Christoph Junghans
Merge "Use External BLAS/LAPACK by default" into releas...
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2012-05-22
Roland Schulz
Use External BLAS/LAPACK by default
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2012-05-07
Teemu Murtola
Merge branch 'gerrit/release-4-5-patches' into release-4-6
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2012-05-05
Teemu Murtola
Drop support for pre-1.5.3 git for version info.
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2012-05-01
Roland Schulz
Fix Windows specific cmake hacks
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2012-04-29
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-04-29
David van der Spoel
Merge "changed number of iatoms for F_SETTLE from 1...
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2012-04-29
David van der Spoel
Merge "added support for graphs not starting at 0"...
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2012-04-29
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-04-28
Mark Abraham
Merge "Remove checks based on Generator" into release...
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2012-04-27
Roland Schulz
Remove checks based on Generator
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2012-04-26
Berk Hess
Merge "Merge release-4-5-patches into release-4-6"...
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2012-04-26
Berk Hess
Merge release-4-5-patches into release-4-6
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2012-04-23
Christoph Junghans
Merge "compiler flag fixes" into release-4-6
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2012-04-22
Roland Schulz
Merge "enable command line option cheking in mdrun...
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2012-04-19
Szilard Pall
compiler flag fixes
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2012-04-16
Roland Schulz
Merge "changed default for nstxout, nstvout and nstlog...
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2012-04-16
Roland Schulz
Merge "checkpoint files now contain a double precision...
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2012-04-16
David van der Spoel
Merge "Added support for dssp2.X with the -ver option...
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2012-04-16
David van der Spoel
Merge "Expanded the help text regarding the -r2 and...
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