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sci-chemistry/nwchem

Delivering High-Performance Computational Chemistry to Science

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  • nwchem-6.5_p26243-r1
    ~x86 ~amd64
    blas cuda infiniband lapack mpi doc examples int64 nwchem-tests openmp mrcc python scalapack python_targets_python2_7 python_single_target_python2_7

    View      Download      Browse     License: ECL-2.0   
    Overlay: science (layman)
  • nwchem-6.3_p2-r1
    ~x86 ~amd64
    blas mpi doc examples nwchem-tests openmp mrcc python python_targets_python2_7 python_single_target_python2_7

    View      Download      Browse     License: ECL-2.0   
    Overlay: science (layman)