gromacs

Install command: 
brew install gromacs

Versatile package for molecular dynamics calculations

https://www.gromacs.org/

License: LGPL-2.1-or-later

Formula JSON API: /api/formula/gromacs.json

Bottle JSON API: /api/bottle/gromacs.json

Formula code: gromacs.rb on GitHub

Bottle (binary package) installation support provided for:

Intel monterey ✅
big sur ✅
catalina ✅
64-bit linux ✅
Apple Silicon monterey ✅
big sur ✅

Current versions:

stable ✅ 2022.1

Depends on:

fftw 3.3.10 C routines to compute the Discrete Fourier Transform
gcc 11.3.0 GNU compiler collection
openblas 0.3.20 Optimized BLAS library

Depends on when building from source:

cmake 3.23.1 Cross-platform make
GMXRC and other scripts installed to:
    $(brew --prefix)/share/gromacs

Analytics (macOS):

Installs (30 days)
gromacs 340
Installs on Request (30 days)
gromacs 341
Build Errors (30 days)
gromacs 0
Installs (90 days)
gromacs 1,037
Installs on Request (90 days)
gromacs 1,036
Installs (365 days)
gromacs 3,282
Installs on Request (365 days)
gromacs 3,281

Analytics (Linux):

Installs (30 days)
gromacs 7
Installs on Request (30 days)
gromacs 7
Build Errors (30 days)
gromacs 0
Installs (90 days)
gromacs 26
Installs on Request (90 days)
gromacs 26
Installs (365 days)
gromacs 74
Installs on Request (365 days)
gromacs 74
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