gmx-single-mpi-cuda

Gromacs version:    VERSION 5.0.4
Precision:          single
Memory model:       64 bit
MPI library:        MPI
OpenMP support:     enabled
GPU support:        enabled
invsqrt routine:    gmx_software_invsqrt(x)
SIMD instructions:  AVX_256
FFT library:        fftw-3.3.3-sse2
RDTSCP usage:       enabled
C++11 compilation:  disabled
TNG support:        enabled
Tracing support:    disabled
Built on:           Wed Jan 14 13:52:28 HKT 2015
Built by:           root@combo.ap.cityu.edu.hk [CMAKE]
Build OS/arch:      Linux 2.6.32-279.14.1.el6.x86_64 x86_64
Build CPU vendor:   GenuineIntel
Build CPU brand:    Intel(R) Xeon(R) CPU E5-2660 0 @ 2.20GHz
Build CPU family:   6   Model: 45   Stepping: 7
Build CPU features: aes apic avx clfsh cmov cx8 cx16 htt lahf_lm mmx msr nonstop_tsc pcid pclmuldq pdcm pdpe1gb popcnt pse rdtscp sse2 sse3 sse4.1 sse4.2 ssse3 tdt x2apic
C compiler:         /share/apps/openmpi/bin/mpicc GNU 4.4.6
C compiler flags:    -mavx   -O3  -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  -Wno-array-bounds
C++ compiler:       /share/apps/openmpi/bin/mpicxx GNU 4.4.6
C++ compiler flags:  -mavx   -O3  -Wextra -Wno-missing-field-initializers -Wpointer-arith -Wall -Wno-unused-function  -O3 -DNDEBUG -fomit-frame-pointer -funroll-all-loops  -Wno-array-bounds
Boost version:      1.55.0 (internal)
CUDA compiler:      /share/apps/cuda/bin/nvcc nvcc: NVIDIA (R) Cuda compiler driver;Copyright (c) 2005-2013 NVIDIA Corporation;Built on Thu_Mar_13_11:58:58_PDT_2014;Cuda compilation tools, release 6.0, V6.0.1
CUDA compiler flags:-gencode;arch=compute_20,code=sm_20;-gencode;arch=compute_20,code=sm_21;-gencode;arch=compute_30,code=sm_30;-gencode;arch=compute_35,code=sm_35;-gencode;arch=compute_35,code=compute_35;-use_fast_math;-Xcompiler;-fPIC ; ;-mavx;-O3;-Wextra;-Wno-missing-field-initializers;-Wpointer-arith;-Wall;-Wno-unused-function;-O3;-DNDEBUG;-fomit-frame-pointer;-funroll-all-loops;-Wno-array-bounds;
CUDA driver:        0.0
CUDA runtime:       0.0