Tue, 31 Mar 2020 20:57:16 UTC

Information for RPM nwchem-7.0.0-6.fc33.src.rpm

ID20986871
Namenwchem
Version7.0.0
Release6.fc33
Epoch
Archsrc
SummaryDelivering High-Performance Computational Chemistry to Science
Description NWChem aims to provide its users with computational chemistry tools that are scalable both in their ability to treat large scientific computational chemistry problems efficiently, and in their use of available parallel computing resources from high-performance parallel supercomputers to conventional workstation clusters. Please cite the following reference when publishing results obtained with NWChem: M. Valiev, E.J. Bylaska, N. Govind, K. Kowalski, T.P. Straatsma, H.J.J. van Dam, D. Wang, J. Nieplocha, E. Apra, T.L. Windus, W.A. de Jong, "NWChem: a comprehensive and scalable open-source solution for large scale molecular simulations" Comput. Phys. Commun. 181, 1477 (2010) There is currently no serial version built.
Build Time2020-03-26 03:02:21 GMT
Size186,152,739
14a07a4d851e18898db11cc85eb98027
LicenseECL 2.0
Buildrootf33-build-20000945-1416948
Provides No Provides
Obsoletes No Obsoletes
Conflicts No Conflicts
Requires
ga-mpich-devel >= 5.7.2-3
ga-openmpi-devel >= 5.7.2-3
gcc-gfortran
hostname
mpich-devel
openblas-devel
openmpi-devel
openssh-clients
patch
perl-File-Basename
perl-interpreter
python3-devel
rpmlib(CompressedFileNames) <= 3.0.4-1
rpmlib(FileDigests) <= 4.6.0-1
time
Recommends No Recommends
Suggests No Suggests
Supplements No Supplements
Enhances No Enhances
Files
1 through 7 of 7
Name ascending sort Size
2c9a1c7c69744c8663480767cb018838de54a020.tar.gz189,190,223
gnum.patch2,653
hydradebug0_qa.patch722
mcscf_scalapack.patch1,141
nwchem.spec22,189
pspw_scalapack.patch408
solvation_ppc64le.patch1,039
Component of No Buildroots