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- > gmx -version
- ##Output##
- GROMACS: gmx, VERSION 5.0.6
- GROMACS is written by:
- Emile Apol Rossen Apostolov Herman J.C. Berendsen Par Bjelkmar
- Aldert van Buuren Rudi van Drunen Anton Feenstra Sebastian Fritsch
- Gerrit Groenhof Christoph Junghans Peter Kasson Carsten Kutzner
- Per Larsson Justin A. Lemkul Magnus Lundborg Pieter Meulenhoff
- Erik Marklund Teemu Murtola Szilard Pall Sander Pronk
- Roland Schulz Alexey Shvetsov Michael Shirts Alfons Sijbers
- Peter Tieleman Christian Wennberg Maarten Wolf
- and the project leaders:
- Mark Abraham, Berk Hess, Erik Lindahl, and David van der Spoel
- Copyright (c) 1991-2000, University of Groningen, The Netherlands.
- Copyright (c) 2001-2014, The GROMACS development team at
- Uppsala University, Stockholm University and
- the Royal Institute of Technology, Sweden.
- check out http://www.gromacs.org for more information.
- GROMACS is free software; you can redistribute it and/or modify it
- under the terms of the GNU Lesser General Public License
- as published by the Free Software Foundation; either version 2.1
- of the License, or (at your option) any later version.
- GROMACS: gmx, VERSION 5.0.6
- Executable: /usr/local/gromacs/bin/gmx
- Library dir: /usr/local/gromacs/share/gromacs/top
- Command line:
- gmx --version
- Gromacs version: VERSION 5.0.6
- Precision: single
- Memory model: 32 bit
- MPI library: thread_mpi
- OpenMP support: enabled
- GPU support: disabled
- invsqrt routine: gmx_software_invsqrt(x)
- SIMD instructions: AVX2_256
- FFT library: fftw-3.3.3-sse2
- RDTSCP usage: enabled
- C++11 compilation: enabled
- TNG support: enabled
- Tracing support: disabled
- Built on: Thu Oct 1 09:51:11 EDT 2015
- Built by: simon@researchBox [CMAKE]
- Build OS/arch: Linux 3.19.0-26-generic i686
- Build CPU vendor: GenuineIntel
- Build CPU brand: Intel(R) Core(TM) i7-4550U CPU @ 1.50GHz
- Build CPU family: 6 Model: 69 Stepping: 1
- Build CPU features: aes apic avx avx2 clfsh cmov cx8 cx16 f16c fma htt lahf_lm mmx msr nonstop_tsc pcid pclmuldq pdcm pdpe1gb popcnt pse rdrnd rdtscp sse2 sse3 sse4.1 sse4.2 ssse3 tdt x2apic
- C compiler: /usr/bin/cc GNU 4.8.4
- C compiler flags: -march=core-avx2 -Wno-maybe-uninitialized -Wextra -Wno-missing-field-initializers -Wno-sign-compare -Wpointer-arith -Wall -Wno-unused -Wunused-value -Wunused-parameter -O3 -DNDEBUG -fomit-frame-pointer -funroll-all-loops -fexcess-precision=fast -Wno-array-bounds
- C++ compiler: /usr/bin/c++ GNU 4.8.4
- C++ compiler flags: -march=core-avx2 -std=c++0x -Wextra -Wno-missing-field-initializers -Wpointer-arith -Wall -Wno-unused-function -O3 -DNDEBUG -fomit-frame-pointer -funroll-all-loops -fexcess-precision=fast -Wno-array-bounds
- Boost version: 1.55.0 (internal)
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