nwchem

Install command:
brew install nwchem

High-performance computational chemistry tools

https://nwchemgit.github.io

License: ECL-2.0

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

Formula code on GitHub

Bottle (binary package) installation support provided for macOS releases:

Intel x86_64 big sur, catalina, mojave, high sierra
Apple Silicon

Current versions:

stable 7.0.2

Depends on:

gcc 10.2.0 GNU compiler collection
open-mpi 4.0.5 High performance message passing library
openblas 0.3.13 Optimized BLAS library
python@3.9 3.9.1 Interpreted, interactive, object-oriented programming language
scalapack 2.1.0 High-performance linear algebra for distributed memory machines

Analytics:

Installs (30 days)
nwchem 34
Installs on Request (30 days)
nwchem 35
Build Errors (30 days)
nwchem 4
Installs (90 days)
nwchem 99
NWChem 1
Installs on Request (90 days)
nwchem 100
NWChem 1
Installs (365 days)
nwchem 357
Installs on Request (365 days)
nwchem 357
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