Homebrew Formulae

gromacs

Versatile package for molecular dynamics calculations

http://www.gromacs.org/

/api/formula/gromacs.json (JSON API)

Formula code on GitHub

Current versions:

stable	✅	2018.2
bottle	🍾	high_sierra, sierra, el_capitan

Options:

--with-double	Enables double precision
--with-mpi	Enable parallel support
--with-x11	Build with x11 support

Depends on:

fftw	✅	3.3.8	C routines to compute the Discrete Fourier Transform
gsl	✅	2.5	Numerical library for C and C++

Depends on when building from source:

cmake

✅

3.12.0

Cross-platform make

Requires: :x11

Analytics:

Installs (30 days)
gromacs	123
gromacs --with-mpi	8
gromacs --with-double	6
gromacs --with-double --with-mpi --with-x11	2
gromacs --with-mpi --with-x11	2
Installs on Request (30 days)
gromacs	103
gromacs --with-mpi	8
gromacs --with-double	6
gromacs --with-double --with-mpi --with-x11	2
gromacs --with-mpi --with-x11	2
gromacs --with-double --with-mpi	1
Build Errors (30 days)
gromacs	0
Installs (90 days)
gromacs	320
gromacs --with-double --with-mpi	27
gromacs --with-double	13
Installs on Request (90 days)
gromacs	284
gromacs --with-double --with-mpi	26
gromacs --with-double	13
gromacs --with-double --with-x11	3
gromacs --with-x11	3
Installs (365 days)
gromacs	1,051
gromacs --with-double --with-mpi	29
gromacs --with-double --with-mpi --with-x11	23
gromacs --with-double	21
Installs on Request (365 days)
gromacs	889
gromacs --with-double --with-mpi	28
gromacs --with-double --with-mpi --with-x11	23
gromacs --with-double	21