Commits · v4.6-beta3 · googyer / GROMACS · GitLab

Dec 22, 2012
- New beta release: 4.6-beta3 · 492378e3
  Mark Abraham authored Dec 19, 2012
  View commits for tag v4.6-beta3 v4.6-beta3
  492378e3
- cmake: mark FFTW_HAVE_{SIMD,AVX} as advanced · bd13a549
  Christoph Junghans authored Dec 17, 2012
  bd13a549
- Add missing visibility exports · df484930
  Roland Schulz authored Dec 20, 2012
  df484930
Dec 21, 2012
- Merge "Remove non-functional compiler override for MacOSX." into release-4-6 · e460e1f2
  Christoph Junghans authored Dec 21, 2012
  
  e460e1f2
- Fixed gmx_cpuid not working on non-x86 · d24f81b3
  Erik Lindahl authored Dec 20, 2012
  d24f81b3
- Remove non-functional compiler override for MacOSX. · ddb6b523
  Teemu Murtola authored Dec 21, 2012
  ddb6b523
Dec 20, 2012
- fix incorrect gmx_fatal argument order · 5721534c
  Szilard Pall authored Dec 21, 2012
  5721534c
- Merge "cmake: added option to disable quotes" into release-4-6 · cb990770
  Erik Lindahl authored Dec 20, 2012
  
  cb990770
- Merge "Small fix for g_tune_pme" into release-4-6 · 54ab9fc1
  Erik Lindahl authored Dec 20, 2012
  
  54ab9fc1
- Merge "Fixes for andersen temperature control" into release-4-6 · c25c53d0
  Erik Lindahl authored Dec 20, 2012
  
  c25c53d0
- Merge "Fixes for expanded ensemble and HREPEX" into release-4-6 · efe7622a
  Erik Lindahl authored Dec 20, 2012
  
  efe7622a
- Merge "Fixed AVX256 double-precision kernels for gcc" into release-4-6 · dc2e2671
  Christoph Junghans authored Dec 20, 2012
  
  dc2e2671
- cmake: added option to disable quotes · fe464a5f
  Christoph Junghans authored Dec 19, 2012
  fe464a5f
- Fixes for andersen temperature control · 56ae8c94
  Michael Shirts authored Dec 15, 2012
  56ae8c94
- Fixes for expanded ensemble and HREPEX · ea78ec83
  Michael Shirts authored Dec 09, 2012
  ea78ec83
- Fixed AVX256 double-precision kernels for gcc · c88196ed
  Erik Lindahl authored Dec 20, 2012
  c88196ed
- Fix for the pressure in MTTK with constraints + dispersion · b18b7833
  Michael Shirts authored Dec 01, 2012 and Mark Abraham committed Dec 20, 2012
  b18b7833
- Small fix for g_tune_pme · 77b5db00
  Carsten authored Dec 20, 2012
  77b5db00
- fixed recent bugs in LINCS for derivatives · 4d3a2d48
  Berk Hess authored Dec 20, 2012
  4d3a2d48
Dec 19, 2012
- Merge "Remove the rest of the fortran/power6 acceleration" into release-4-6 · 66ba29b1
  Mark Abraham authored Dec 19, 2012
  
  66ba29b1
- Merge "Always build template program" into release-4-6 · d10c9d20
  Mark Abraham authored Dec 19, 2012
  
  d10c9d20
- Fix Reference build type · d746dd42
  Mark Abraham authored Dec 19, 2012
  d746dd42
- Merge "Avoid using undefined CMake variables" into release-4-6 · 38f723ad
  Szilárd Páll authored Dec 19, 2012
  
  38f723ad
- Merge "Removed orphan file" into release-4-6 · ce44eb34
  Szilárd Páll authored Dec 19, 2012
  
  ce44eb34
- Merge "Fix license text printed by programs." into release-4-6 · 1c8544f5
  Roland Schulz authored Dec 19, 2012
  
  1c8544f5
- Merge changes Idc652236,If03cf569 into release-4-6 · 94f89ef3
  Roland Schulz authored Dec 19, 2012
  94f89ef3
- Merge "issue error if GPU ID is provided with GPU acc. off" into release-4-6 · d7e658f8
  Roland Schulz authored Dec 19, 2012
  
  d7e658f8
- Removed orphan file · ef87f2d6
  Mark Abraham authored Dec 19, 2012
  ef87f2d6
- Avoid using undefined CMake variables · 60e2a2bc
  Mark Abraham authored Dec 19, 2012
  60e2a2bc
Dec 18, 2012
- Merge "Fixes redmine issue #1071" into release-4-6 · 60790b19
  Christoph Junghans authored Dec 19, 2012
  
  60790b19
- issue error if GPU ID is provided with GPU acc. off · 0c37980c
  Szilard Pall authored Dec 17, 2012
  0c37980c
- renamed gmx_x86_simd_macros.h to gmx_simd_macros.h · 6dfb0604
  Berk Hess authored Dec 12, 2012
  6dfb0604
- implemented nbnxn AVX-256 2x(N+N) kernels · 0f26a487
  Berk Hess authored Dec 10, 2012
  0f26a487
Dec 17, 2012
- Merge "reduced PLINCS communication with H-bond constraints" into release-4-6 · 46d3f7f6
  Szilárd Páll authored Dec 17, 2012
  
  46d3f7f6
- Fix license text printed by programs. · 123678f4
  Teemu Murtola authored Dec 17, 2012
  123678f4
- Remove the rest of the fortran/power6 acceleration · 4e2b6ce6
  Christoph Junghans authored Dec 17, 2012
  4e2b6ce6
Dec 14, 2012
- Fixes redmine issue #1071 · 99faecfa
  Michael Shirts authored Dec 14, 2012
  99faecfa
Dec 13, 2012
- Fix typo · 409a5ea9
  Mark Abraham authored Dec 13, 2012
  409a5ea9
- Always build template program · c22f43f2
  Christoph Junghans authored Nov 25, 2012
  c22f43f2
Dec 11, 2012
- Merge "Fix compilation with PGI" into release-4-6 · 9d1b8157
  Christoph Junghans authored Dec 11, 2012
  
  9d1b8157