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 ✅ 2022.3

Depends on:

fftw 3.3.10 C routines to compute the Discrete Fourier Transform
gcc 12.2.0 GNU compiler collection
openblas 0.3.21 Optimized BLAS library

Depends on when building from source:

cmake 3.24.2 Cross-platform make
GMXRC and other scripts installed to:
    $(brew --prefix)/share/gromacs

Analytics (macOS):

Installs (30 days)
gromacs 359
Installs on Request (30 days)
gromacs 359
Build Errors (30 days)
gromacs 0
Installs (90 days)
gromacs 963
Installs on Request (90 days)
gromacs 964
Installs (365 days)
gromacs 3,666
Installs on Request (365 days)
gromacs 3,665

Analytics (Linux):

Installs (30 days)
gromacs 5
Installs on Request (30 days)
gromacs 5
Build Errors (30 days)
gromacs 0
Installs (90 days)
gromacs 10
Installs on Request (90 days)
gromacs 10
Installs (365 days)
gromacs 58
Installs on Request (365 days)
gromacs 58
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