openmm (8.1.2+dfsg-11) unstable; urgency=medium
* Team upload.
* debian/tests: skip testMTSLangevinIntegrator
testMTSIntegratorExplicit on armel
* Build-Depends: python3-numpy-dev for numpy3 dh sequence
-- Drew Parsons <dparsons@debian.org> Fri, 21 Mar 2025 01:10:37 +0100
openmm (8.1.2+dfsg-10) unstable; urgency=medium
* Team upload.
* fix s390x python test skips
* debian/tests: skip test2ParticlesNonbonded on armel
-- Drew Parsons <dparsons@debian.org> Thu, 20 Mar 2025 09:05:38 +0100
openmm (8.1.2+dfsg-9) unstable; urgency=medium
* Team upload.
* s390x (and hppa, sparc64): skip more tests that time out or fail
-- Drew Parsons <dparsons@debian.org> Wed, 19 Mar 2025 12:24:19 +0100
openmm (8.1.2+dfsg-8) unstable; urgency=medium
* Team upload.
* s390x (and hppa, sparc64): skip test_Constraints_charmm (python)
* debian/tests Depends: dpkg-dev, gcc (for dpkg-architecture)
-- Drew Parsons <dparsons@debian.org> Tue, 18 Mar 2025 17:07:37 +0100
openmm (8.1.2+dfsg-7) unstable; urgency=medium
* Team upload.
* fix control of build-time python tests
-- Drew Parsons <dparsons@debian.org> Tue, 18 Mar 2025 02:40:00 +0100
openmm (8.1.2+dfsg-6) unstable; urgency=medium
* Team upload.
* skip TestATMForce python test on s390x (and hppa, sparc64)
* run pytest verbose on arches requiring python test skips
* update debian/tests
- run pytest over all supported python versions
- run verbose tests on armel
-- Drew Parsons <dparsons@debian.org> Mon, 17 Mar 2025 22:03:10 +0100
openmm (8.1.2+dfsg-5) unstable; urgency=medium
* Team upload.
* skip C++ tests (in ctest) failing for specific arches
* skip MTSLangevinIntegrator in python (pybuild) tests
(it tends to time out). Use pytest (for 'not' operator)
-- Drew Parsons <dparsons@debian.org> Sat, 15 Mar 2025 19:39:57 +0100
openmm (8.1.2+dfsg-4) unstable; urgency=medium
* Team upload.
* debian patch regex_escapes_PR4804.patch applies upstream PR#4804
to fix regex escape strings. Closes: #1085752.
* Build-Depends: python3-setuptools (uses setup.py not pyproject.toml)
Closes: #1080690.
-- Drew Parsons <dparsons@debian.org> Wed, 19 Feb 2025 17:35:42 +0100
openmm (8.1.2+dfsg-3) unstable; urgency=medium
* Backport upstream PR to fix Numpy 2 incompatibility (Closes: #1094700)
* Bump copyright years.
-- Andrius Merkys <merkys@debian.org> Tue, 04 Feb 2025 04:54:26 -0500
openmm (8.1.2+dfsg-2) unstable; urgency=medium
* Backport upstream PR to restore compatibility with scipy
(Closes: #1090255).
-- Andrius Merkys <merkys@debian.org> Thu, 19 Dec 2024 07:43:03 -0500
openmm (8.1.2+dfsg-1) unstable; urgency=medium
* New upstream version 8.1.2+dfsg
-- Andrius Merkys <merkys@debian.org> Tue, 10 Sep 2024 10:06:10 -0400
openmm (8.1.1+dfsg-1) unstable; urgency=medium
* New upstream version 8.1.1+dfsg
* Bump copyright years.
-- Andrius Merkys <merkys@debian.org> Thu, 16 May 2024 02:25:28 -0400
openmm (8.1.0+dfsg-3) unstable; urgency=medium
* Upload to unstable.
* Acknowledge NMU.
-- Andrius Merkys <merkys@debian.org> Thu, 09 May 2024 01:18:55 -0400
openmm (8.0.0+dfsg-6.1) unstable; urgency=medium
* Non-maintainer upload.
* Rename libraries for 64-bit time_t transition. Closes: #1063095
-- Benjamin Drung <bdrung@debian.org> Thu, 29 Feb 2024 12:34:21 +0000
openmm (8.1.0+dfsg-2) experimental; urgency=medium
* Build for all supported Python versions.
-- Andrius Merkys <merkys@debian.org> Wed, 31 Jan 2024 04:39:38 -0500
openmm (8.1.0+dfsg-1) experimental; urgency=medium
* New upstream version 8.1.0+dfsg
* Update debian/copyright.
* Refresh patches.
* Adjust to soversion change.
* Wrap and sort.
* Remove mention of no longer existing file from debian/copyright.
* Add missing copyright stanzas.
-- Andrius Merkys <merkys@debian.org> Thu, 30 Nov 2023 06:35:33 -0500
openmm (8.0.0+dfsg-6) unstable; urgency=medium
* Rename debian/patches/SIMDe -> debian/patches/SIMDe.patch.
* Disable Lepton-JIT integration on armel and armhf.
* Extend ctest timeout to pass tests on slower buildds.
* Do not use NEON on armel and armhf.
-- Andrius Merkys <merkys@debian.org> Wed, 29 Nov 2023 01:41:00 -0500
openmm (8.0.0+dfsg-5) unstable; urgency=medium
[ Michael R. Crusoe ]
* d/patches/SIMDe: enables building on non-(amd64,arm*,ppc64*) systems.
* d/control: build-dep on libsimde-dev to support the above patch.
* d/upstream/metadata: update the repository & bug links (the repo was
renamed).
* d/control,d/rules: add pytest-xdist to speed up test running.
[ Andrius Merkys ]
* Update repository links.
-- Andrius Merkys <merkys@debian.org> Fri, 24 Nov 2023 01:48:51 -0500
openmm (8.0.0+dfsg-4) unstable; urgency=medium
* Fix an error in execute_after_dh_auto_test in debian/rules.
-- Andrius Merkys <merkys@debian.org> Tue, 31 Oct 2023 05:21:45 -0400
openmm (8.0.0+dfsg-3) unstable; urgency=medium
* Adjust tests to path changes (Closes: #1054763)
* Simplify debian/rules.
-- Andrius Merkys <merkys@debian.org> Tue, 31 Oct 2023 03:54:33 -0400
openmm (8.0.0+dfsg-2) unstable; urgency=medium
* Upload to unstable.
* Set upstream metadata fields: Repository-Browse.
* Update standards version to 4.6.2, no changes needed.
* Update homepage.
-- Andrius Merkys <merkys@debian.org> Wed, 21 Jun 2023 01:27:03 -0400
openmm (8.0.0+dfsg-1) experimental; urgency=medium
* New upstream version 8.0.0+dfsg
-- Andrius Merkys <merkys@debian.org> Tue, 31 Jan 2023 02:26:10 -0500
openmm (8.0.0~rc1+dfsg-1) experimental; urgency=medium
* New upstream version 8.0.0~rc1+dfsg
* Bump copyright years.
-- Andrius Merkys <merkys@debian.org> Wed, 18 Jan 2023 03:40:42 -0500
openmm (8.0.0~beta+dfsg-1) experimental; urgency=medium
* New upstream version 8.0.0~beta+dfsg
* Detect alpha, beta and rc releases as well in debian/watch.
* Refresh skip-tests.patch.
* Drop 3527.patch, integrated upstream.
* Adjust package names to soname change.
* Rename Python package python3-simtk -> python3-openmm.
* Simplify debian/rules.
* Remove debian/copyright entry for no longer existing file.
-- Andrius Merkys <merkys@debian.org> Tue, 25 Oct 2022 06:59:05 -0400
openmm (7.7.0+dfsg-9) unstable; urgency=medium
* Adjust cmake build directory in debian/rules to build on i686 and some
other architectures.
-- Andrius Merkys <merkys@debian.org> Sat, 01 Oct 2022 06:52:44 -0400
openmm (7.7.0+dfsg-8) unstable; urgency=medium
* Fix OpenCL plugin build.
* Turn off OpenCL tests as they cannot be run on buildds.
-- Andrius Merkys <merkys@debian.org> Wed, 28 Sep 2022 09:52:38 -0400
openmm (7.7.0+dfsg-7) unstable; urgency=medium
* Fix default plugin location. Earlier hard-coded location did not follow the
real install path for shared libraries, thus only the reference platform
for OpenMM was found.
-- Andrius Merkys <merkys@debian.org> Thu, 23 Jun 2022 06:32:27 -0400
openmm (7.7.0+dfsg-6) unstable; urgency=medium
* Backport upstream patch for GCC-12 FTBFS (Closes: #1013010).
-- Andrius Merkys <merkys@debian.org> Mon, 20 Jun 2022 03:18:38 -0400
openmm (7.7.0+dfsg-5) unstable; urgency=medium
* Fix reproducibility issue by un-embedding build paths.
* Set OPENMM_CUDA_COMPILER in debian/rules for downstream builds with
nvidia-cuda-toolkit.
* Add Provides and X-Python3-Version to Python package.
* Update debian/todo.
-- Andrius Merkys <merkys@debian.org> Tue, 05 Apr 2022 11:20:27 -0400
openmm (7.7.0+dfsg-4) unstable; urgency=medium
* Add missing dependencies for python3-simtk.
* Add autopkgtest.
* Set RPATH for Python to find libraries in OpenMM private location
(Closes: #1004750).
* Add ${shlibs:Depends} to libopenmm-dev.
* Correct capitalization for Python programming language name.
* Bump copyright year.
* Set upstream metadata fields: Repository, Repository-Browse.
* Update standards version to 4.6.0, no changes needed.
-- Andrius Merkys <merkys@debian.org> Tue, 22 Mar 2022 11:22:16 -0400
openmm (7.7.0+dfsg-3) unstable; urgency=medium
* Reverting cleaning up debian/rules as removed variables were needed
by the build system.
-- Andrius Merkys <merkys@debian.org> Mon, 24 Jan 2022 03:34:02 -0500
openmm (7.7.0+dfsg-2) unstable; urgency=medium
* Upload to unstable.
* Setting CMAKE_BUILD_RPATH_USE_ORIGIN=ON to fix reproducible build
(Closes: #1004005).
* Cleaning up debian/rules.
* Moving libOpenMMAmoeba.so, libOpenMMDrude.so and libOpenMMRPMD.so to
libdevel package.
* Updating debian/todo.
-- Andrius Merkys <merkys@debian.org> Mon, 24 Jan 2022 01:45:05 -0500
openmm (7.7.0+dfsg-1) experimental; urgency=medium
* New upstream version 7.7.0+dfsg
* Accommodating SONAME bump.
* Refreshing skip-tests.patch, skipping two more tests.
* Building python3-simtk package.
* Including libOpenMMAmoeba.so, libOpenMMDrude.so and libOpenMMRPMD.so in
libs package (Closes: #992931).
-- Andrius Merkys <merkys@debian.org> Thu, 23 Dec 2021 08:34:13 -0500
openmm (7.6.0+dfsg-1) unstable; urgency=medium
* New upstream version 7.6.0+dfsg
-- Andrius Merkys <merkys@debian.org> Sat, 28 Aug 2021 02:31:22 -0400
openmm (7.5.1+dfsg-2) unstable; urgency=medium
* No-changes source-only upload to unstable.
-- Andrius Merkys <merkys@debian.org> Sun, 15 Aug 2021 01:37:12 -0400
openmm (7.5.1+dfsg-1) experimental; urgency=medium
[ Steffen Möller ]
* Update metadata - added refs to bio.tools, conda, SciCrunch
[ Andrius Merkys ]
* New upstream version 7.5.1+dfsg
* Skipping yet another test due to unsupported platform.
* Adding a binary package for plugins.
* Updating copyright years.
-- Andrius Merkys <merkys@debian.org> Fri, 02 Jul 2021 03:16:58 -0400
openmm (7.5.0+dfsg-1) unstable; urgency=medium
* New upstream version 7.5.0+dfsg (Closes: #966839)
* Reordering copyright statements.
-- Andrius Merkys <merkys@debian.org> Thu, 10 Dec 2020 09:24:19 -0500
openmm (7.4.0.491.gac5a8f71+dfsg-1) unstable; urgency=medium
[ Andreas Tille ]
* New upstream version
* debhelper-compat 13 (routine-update)
* Respect DEB_BUILD_OPTIONS in override_dh_auto_test target (routine-
update)
* Add salsa-ci file (routine-update)
* Set upstream metadata fields: Bug-Database, Bug-Submit.
[ Andrius Merkys ]
* Refreshing skip-tests.patch.
* Skipping yet another failing test.
* Listing not installed files in debian/not-installed.
-- Andrius Merkys <merkys@debian.org> Wed, 22 Jul 2020 05:55:25 -0400
openmm (7.4.0.417.g1c162ef2+dfsg-1) unstable; urgency=medium
* Initial release (Closes: #924251)
-- Andrius Merkys <merkys@debian.org> Mon, 08 Jun 2020 11:57:26 -0400