pythonPackages.ovito: init at 3.0.0

pkgs/development/python-modules/ovito/default.nix

@@ -0,0 +1,33 @@
+{ stdenv, fetchgit
+, cmake
+, qtbase, libav, netcdf, qscintilla, zlib, boost, git, fftw, hdf5, libssh
+, pythonPackages
+}:
+
+stdenv.mkDerivation rec {
+  # compilation error in 2.9.0 https://gitlab.com/stuko/ovito/issues/40
+  # This is not the "released" 3.0.0 just a commit
+  version = "3.0.0";
+  name = "ovito-${version}";
+
+  src = fetchgit {
+    url = "https://gitlab.com/stuko/ovito";
+    rev = "a28c28182a879d2a1b511ec56f9845306dd8a4db";
+    sha256 = "1vqzv3gzwf8r0g05a7fj8hdyvnzq2h3wdfck7j6n1av6rvp7hi5r";
+  };
+
+  buildInputs = [ cmake libav netcdf qscintilla zlib boost zlib git fftw hdf5 libssh ];
+  propagatedBuildInputs = with pythonPackages; [ sphinx numpy sip pyqt5 matplotlib ase ];
+
+  enableParallelBuilding = true;
+
+  meta = with stdenv.lib; {
+    description = "Scientific visualization and analysis software for atomistic simulation data";
+    homepage = https://www.ovito.org;
+    license = licenses.gpl3;
+    maintainers = [ maintainers.costrouc ];
+    # ensures not built on hydra
+    # https://github.com/NixOS/nixpkgs/pull/46846#issuecomment-436388048
+    hydraPlatforms = [ ];
+  };
+}

pkgs/top-level/python-packages.nix

@@ -454,6 +454,10 @@ in {
 
   outcome = callPackage ../development/python-modules/outcome {};
 
+  ovito = toPythonModule (pkgs.libsForQt5.callPackage ../development/python-modules/ovito {
+      pythonPackages = self;
+    });
+
   palettable = callPackage ../development/python-modules/palettable { };
 
   pathlib = callPackage ../development/python-modules/pathlib { };