diff --git a/pkgs/development/python-modules/ase/default.nix b/pkgs/development/python-modules/ase/default.nix index 979cebb0d666..142a1691e235 100644 --- a/pkgs/development/python-modules/ase/default.nix +++ b/pkgs/development/python-modules/ase/default.nix @@ -3,8 +3,6 @@ stdenv, fetchFromGitLab, buildPythonPackage, - isPy27, - fetchPypi, pythonAtLeast, # build-system @@ -29,14 +27,14 @@ buildPythonPackage rec { pname = "ase"; - version = "3.25.0-unstable-2025-06-24"; + version = "3.26.0"; pyproject = true; src = fetchFromGitLab { owner = "ase"; repo = "ase"; - rev = "4e22dabfbe7ae2329e50260ca1b6f08a83527ac3"; - hash = "sha256-ehMyVtPxfTxT8T418VyLGnUEyYip4LPTTaGL0va7qgM="; + tag = version; + hash = "sha256-1738NQPgOqSr2PZu1T2b9bL0V+ZzGk2jcWBhLF21VQs="; }; build-system = [ setuptools ]; @@ -79,7 +77,8 @@ buildPythonPackage rec { meta = { description = "Atomic Simulation Environment"; - homepage = "https://wiki.fysik.dtu.dk/ase/"; + homepage = "https://ase-lib.org/"; + changelog = "https://ase-lib.org/releasenotes.html"; license = lib.licenses.lgpl21Plus; maintainers = [ ]; }; diff --git a/pkgs/development/python-modules/dscribe/default.nix b/pkgs/development/python-modules/dscribe/default.nix index 658b5dd45044..51d7a9498506 100644 --- a/pkgs/development/python-modules/dscribe/default.nix +++ b/pkgs/development/python-modules/dscribe/default.nix @@ -79,6 +79,17 @@ buildPythonPackage rec { "test_examples" ]; + # Broken due to use of missing _get_constraints attr in ase >= 3.26.0 + # https://github.com/SINGROUP/dscribe/issues/160 + disabledTestPaths = [ + "tests/test_examples.py::test_examples" + "tests/test_general.py::test_atoms_to_system" + "tests/test_lmbtr.py" + "tests/test_mbtr.py" + "tests/test_sinematrix.py" + "tests/test_valle_oganov.py" + ]; + meta = { description = "Machine learning descriptors for atomistic systems"; homepage = "https://github.com/SINGROUP/dscribe";