Commit 9847defe authored by Christof Schulze's avatar Christof Schulze 😎
Browse files

MAPS updated to version 4.3

parent 8bf3493c
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scienomics/4.3

0 → 100644
+44 −0
Original line number Diff line number Diff line
#%Module 1.0
#
#  Scienomics MAPS module for use with 'environment-modules' package:
#
#     /etc/profile.d/scienomics.sh and /etc/profile.d/scienomics.csh
#
set     version      4.3

proc ModulesHelp { } {
        global version

        puts stderr "\tAdds Scienomics MAPS to your PATH environment variable"
        puts stderr "\n\t including LAMMPS (31 Mar 2017)"
        puts stderr "\n\tVersion $version\n"
}

module-whatis   "activates Scienomics MAPS $version (x86_64-Linux,MPI)"


set	pkghome		  /opt/Scienomics

conflict        mpi

setenv			    MAPS_BASE	   $pkghome

prepend-path    path         $pkghome/LAMMPS



setenv          BABEL_DATADIR   $pkghome/MAPS-4.3/OpenBabel/share/openbabel/2.4.0
setenv          BABEL_LIBDIR    $pkghome/MAPS-4.3/OpenBabel/lib/openbabel/2.4.0
setenv          CONV_RSH        ssh
setenv          DRG7_LICENSEDATA $pkghome/Dragon/dragon7_license.txt

prepend-path    LD_LIBRARY_PATH  $pkghome/MAPS-4.3/lib

prepend-path    LD_LIBRARY_PATH  $pkghome/MAPS-4.3/OpenBabel/lib

prepend-path    MANPATH          /opt/intel/impi/4.0.2.003/man
prepend-path    PATH             $pkghome/bin
prepend-path    PATH             /opt/intel/impi/4.0.2.003/bin64


unset pkghome