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
