molequeue: init at 0.9.0

molequeue: review comments
This commit is contained in:
Phillip Seeber 2021-07-27 18:42:50 +02:00
parent 3ea182f321
commit b5bf1346c0
2 changed files with 35 additions and 0 deletions

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@ -0,0 +1,33 @@
{ lib, stdenv, fetchFromGitHub, cmake, qttools, wrapQtAppsHook }:
stdenv.mkDerivation rec {
pname = "molequeue";
version = "0.9.0";
src = fetchFromGitHub {
owner = "OpenChemistry";
repo = pname;
rev = version;
sha256 = "+NoY8YVseFyBbxc3ttFWiQuHQyy1GN8zvV1jGFjmvLg=";
};
nativeBuildInputs = [
cmake
wrapQtAppsHook
];
buildInputs = [ qttools ];
postFixup = ''
substituteInPlace $out/lib/cmake/molequeue/MoleQueueConfig.cmake \
--replace "''${MoleQueue_INSTALL_PREFIX}/$out" "''${MoleQueue_INSTALL_PREFIX}"
'';
meta = with lib; {
description = "Desktop integration of high performance computing resources";
maintainers = with maintainers; [ sheepforce ];
homepage = "https://github.com/OpenChemistry/molequeue";
platforms = platforms.linux;
license = licenses.bsd3;
};
}

View file

@ -29850,6 +29850,8 @@ in
eigen = eigen2;
};
molequeue = libsForQt5.callPackage ../development/libraries/science/chemistry/molequeue { };
chemtool = callPackage ../applications/science/chemistry/chemtool { };
d-seams = callPackage ../applications/science/chemistry/d-seams {};