PySDM 3.0.0rc36__tar.gz → 3.0.0rc38__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- pysdm-3.0.0rc36/.github/workflows/tutorial_code.yml → pysdm-3.0.0rc38/.github/workflows/docs_code_snippets.yml +39 -24
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/workflows/pdoc.yml +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/workflows/precommit.yml +5 -3
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/workflows/pypi.yml +3 -3
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/workflows/stale.yml +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/workflows/tests.yml +6 -6
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.gitignore +9 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PKG-INFO +11 -5
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/dummy_attribute.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/isotopes/bolin_numbers.py +4 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/__init__.py +6 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/backend_methods.py +2 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/index.py +2 -4
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/indexed_storage.py +9 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/storage_utils.py +3 -3
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/methods/__init__.py +7 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/methods/collisions_methods.py +199 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/methods/index_methods.py +31 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/methods/moments_methods.py +212 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/methods/pair_methods.py +129 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/methods/physics_methods.py +29 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/random.py +56 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/storage.py +142 -0
- pysdm-3.0.0rc38/PySDM/backends/impl_jax/storage_impl.py +17 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/index_methods.py +8 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/isotope_methods.py +29 -14
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/moments_methods.py +14 -8
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/pair_methods.py +1 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/random.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/storage.py +10 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_thrust_rtc/methods/collisions_methods.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_thrust_rtc/methods/index_methods.py +2 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_thrust_rtc/methods/isotope_methods.py +2 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_thrust_rtc/methods/moments_methods.py +2 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_thrust_rtc/random.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_thrust_rtc/storage.py +17 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_thrust_rtc/test_helpers/fake_thrust_rtc.py +2 -0
- pysdm-3.0.0rc38/PySDM/backends/jax.py +50 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/dynamics/collisions/collision.py +4 -4
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/dynamics/impl/random_generator_optimizer.py +13 -5
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/dynamics/isotopic_fractionation.py +3 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/formulae.py +10 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/impl/particle_attributes.py +2 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/impl/particle_attributes_factory.py +2 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/initialisation/sampling/spatial_sampling.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/initialisation/sampling/spectral_sampling.py +2 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/initialisation/sampling/spectro_glacial_sampling.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/particulator.py +4 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/physics/drop_growth/howell_1949.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/physics/isotope_diffusivity_ratios/grahams_law.py +12 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/physics/isotope_relaxation_timescale/zaba_et_al.py +4 -8
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/products/impl/rate_product.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/products/impl/spectrum_moment_product.py +2 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/products/size_spectral/particle_volume_versus_radius_logarithm_spectrum.py +0 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/README.md +6 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/docs/bibliography.json +2 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/docs/markdown/pysdm_landing.md +4 -3
- pysdm-3.0.0rc38/examples/PySDM_examples/Gedzelman_and_Arnold_1994/fig_2.ipynb +645 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/examples/pyproject.toml +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/pyproject.toml +5 -3
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/pysdm.egg-info/PKG-INFO +11 -5
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/pysdm.egg-info/SOURCES.txt +28 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/pysdm.egg-info/requires.txt +4 -2
- pysdm-3.0.0rc38/pysdm.egg-info/scm_file_list.json +1068 -0
- pysdm-3.0.0rc38/pysdm.egg-info/scm_version.json +8 -0
- pysdm-3.0.0rc38/tests/devops_tests/.github/workflows/checks.yml +54 -0
- pysdm-3.0.0rc38/tests/devops_tests/.github/workflows/stale.yml +27 -0
- pysdm-3.0.0rc38/tests/devops_tests/.pre-commit-config.yaml +21 -0
- pysdm-3.0.0rc38/tests/devops_tests/LICENSE +674 -0
- pysdm-3.0.0rc38/tests/devops_tests/README.md +2 -0
- pysdm-3.0.0rc38/tests/devops_tests/requirements.txt +10 -0
- pysdm-3.0.0rc38/tests/devops_tests/test_files/empty.ipynb +33 -0
- pysdm-3.0.0rc38/tests/devops_tests/test_files/empty.pdf +0 -0
- pysdm-3.0.0rc38/tests/devops_tests/test_notebooks.py +85 -0
- pysdm-3.0.0rc38/tests/devops_tests/test_todos_annotated.py +72 -0
- pysdm-3.0.0rc38/tests/devops_tests/utils.py +27 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/smoke_tests/box/dejong_and_mackay_et_al_2023/test_fig_7.py +1 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/smoke_tests/no_env/gedzelman_and_arnold_1994/test_fig_2.py +19 -22
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/attributes/test_area_radius.py +2 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/attributes/test_isotopes.py +2 -2
- pysdm-3.0.0rc38/tests/unit_tests/attributes/test_water_mass.py +26 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/backends/storage/test_basic_ops.py +21 -0
- pysdm-3.0.0rc38/tests/unit_tests/backends/storage/test_row_view.py +17 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/backends/test_collisions_methods.py +42 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/backends/test_isotope_methods.py +53 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/backends/test_pair_methods.py +72 -7
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/backends/test_physics_methods.py +7 -3
- pysdm-3.0.0rc38/tests/unit_tests/conftest.py +34 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/dynamics/collisions/test_sdm_single_cell.py +26 -19
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/dynamics/test_isotopic_fractionation.py +2 -2
- pysdm-3.0.0rc38/tests/unit_tests/impl/test_moments.py +226 -0
- pysdm-3.0.0rc38/tests/unit_tests/physics/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/physics/test_isotope_diffusivity_ratios.py +2 -1
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/physics/test_isotope_relaxation_timescale.py +1 -3
- pysdm-3.0.0rc38/tests/unit_tests/products/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/products/test_impl.py +2 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/products/test_particle_size_spectrum.py +2 -2
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/tests/unit_tests/test_formulae.py +11 -0
- pysdm-3.0.0rc36/examples/PySDM_examples/Gedzelman_and_Arnold_1994/fig_2.ipynb +0 -627
- pysdm-3.0.0rc36/tests/unit_tests/conftest.py +0 -17
- pysdm-3.0.0rc36/tests/unit_tests/impl/test_moments.py +0 -125
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.binder/apt.txt +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.binder/postBuild +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.binder/requirements.txt +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.codecov.yml +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/actions/env-setup/action.yml +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/actions/set-pip-path-and-cache-key/action.yml +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/dependabot.yml +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/workflows/cancel.yml +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.github/workflows/urlcheck.yml +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.gitmodules +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.pre-commit-config.yaml +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.pylintrc +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/.zenodo.json +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/LICENSE +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/chemistry/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/chemistry/acidity.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/chemistry/concentration.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/chemistry/hydrogen_ion_concentration.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/ice/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/ice/cooling_rate.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/ice/freezing_supersaturation.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/ice/freezing_temperature.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/ice/immersed_surface_area.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/attribute_registry.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/base_attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/cell_attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/derived_attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/extensive_attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/intensive_attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/maximum_attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/mole_amount.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/impl/temperature_variation_option_attribute.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/isotopes/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/isotopes/delta.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/isotopes/moles.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/numerics/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/numerics/cell_id.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/numerics/cell_origin.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/numerics/position_in_cell.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/area.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/critical_saturation.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/critical_volume.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/diffusional_growth_mass_change.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/dry_radius.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/dry_volume.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/equilibrium_saturation.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/heat.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/hygroscopicity.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/multiplicity.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/radius.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/relative_fall_velocity.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/reynolds_number.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/temperature.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/terminal_velocity.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/volume.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/attributes/physics/water_mass.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/freezing_attributes.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/pair_indicator.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/pairwise_storage.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_common/random_common.py +0 -0
- {pysdm-3.0.0rc36/examples/PySDM_examples/Spichtinger_et_al_2023/data → pysdm-3.0.0rc38/PySDM/backends/impl_jax}/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/atomic_operations.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/conf.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/__init__.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/chemistry_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/collisions_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/condensation_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/deposition_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/displacement_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/fragmentation_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/freezing_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/physics_methods.py +0 -0
- {pysdm-3.0.0rc36 → pysdm-3.0.0rc38}/PySDM/backends/impl_numba/methods/sedimentation_removal_0d_methods.py +0 -0
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The [`Jax`](https://docs.jax.dev/en/latest/index.html) backend (aliased ``JAX``) is flexible and works with any device configurations (CPU/GPU/TPU), utilising the same backend API. As It is in early development, only simple coagulation cases in single-cell simulations are supported.
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## Dependencies and Installation
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PySDM dependencies are: [Numpy](https://numpy.org/), [Numba](http://numba.pydata.org/), [SciPy](https://scipy.org/),
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PySDM dependencies are: [Numpy](https://numpy.org/), [Numba](http://numba.pydata.org/), [Jax](https://docs.jax.dev/en/latest/index.html), [SciPy](https://scipy.org/),
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Derived droplet attribute representing the Bolin number for heavy
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water isotopologues (
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water isotopologues (2H, 17O, 18O substitutions).
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Heavy isotopologue identifier (entry of ``HEAVY_ISOTOPES``).
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backend.shuffle_global(
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)
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attribute storage class featuring particle permutation logic
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"""
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def to_ndarray(self, *, raw=False):
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raise NotImplementedError()
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def
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def upload(self, data):
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@@ -0,0 +1,199 @@
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"""
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JAX implementation of backend methods for particle collisions
|
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"""
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from functools import cached_property
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import jax
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from PySDM.backends.impl_common.backend_methods import BackendMethods
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from PySDM.backends.impl_jax.storage import Storage
|
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|
+
def flag_zero_multiplicity(j, k, multiplicity, healthy):
|
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raise NotImplementedError()
|
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|
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|
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|
|
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|
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class CollisionsMethods(BackendMethods):
|
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@cached_property
|
|
20
|
+
def _collision_coalescence_body(self):
|
|
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|
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@jax.jit
|
|
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|
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def body( # pylint: disable=too-many-locals
|
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|
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multiplicity,
|
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|
+
idx,
|
|
25
|
+
attributes,
|
|
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|
+
gamma,
|
|
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|
+
is_first_in_pair,
|
|
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|
+
):
|
|
29
|
+
i = jnp.arange(len(multiplicity) // 2)
|
|
30
|
+
offset = 1 - is_first_in_pair[2 * i]
|
|
31
|
+
# offset = 0
|
|
32
|
+
j = idx[2 * i + offset]
|
|
33
|
+
k = idx[2 * i + 1 + offset]
|
|
34
|
+
mj = multiplicity[j]
|
|
35
|
+
mk = multiplicity[k]
|
|
36
|
+
|
|
37
|
+
new_n = mj - jnp.int64(gamma[i]) * mk # ?
|
|
38
|
+
|
|
39
|
+
pos_mask = new_n > 0
|
|
40
|
+
zero_mask = ~pos_mask
|
|
41
|
+
|
|
42
|
+
# CASE new_n > 0
|
|
43
|
+
mult_pos_updates = jnp.where(pos_mask, new_n, multiplicity[j])
|
|
44
|
+
attr_pos_delta = gamma[i] * attributes[:, j]
|
|
45
|
+
|
|
46
|
+
attr_pos_delta = attr_pos_delta * pos_mask
|
|
47
|
+
|
|
48
|
+
# CASE new_n <= 0
|
|
49
|
+
new_attr = gamma[i] * attributes[:, j] + attributes[:, k]
|
|
50
|
+
|
|
51
|
+
new_attr = new_attr * zero_mask
|
|
52
|
+
|
|
53
|
+
mult_j = jnp.where(
|
|
54
|
+
pos_mask,
|
|
55
|
+
mult_pos_updates,
|
|
56
|
+
jnp.where(zero_mask, mk // 2, multiplicity[j]),
|
|
57
|
+
)
|
|
58
|
+
mult_k = jnp.where(
|
|
59
|
+
zero_mask,
|
|
60
|
+
jnp.where(zero_mask, mk - (mk // 2), multiplicity[k]),
|
|
61
|
+
multiplicity[k],
|
|
62
|
+
)
|
|
63
|
+
|
|
64
|
+
multiplicity = multiplicity.at[j].set(mult_j)
|
|
65
|
+
|
|
66
|
+
multiplicity = multiplicity.at[k].set(mult_k)
|
|
67
|
+
|
|
68
|
+
attributes = attributes.at[:, k].add(attr_pos_delta)
|
|
69
|
+
|
|
70
|
+
attributes = attributes.at[:, j].set(
|
|
71
|
+
jnp.where(zero_mask, new_attr, attributes[:, j])
|
|
72
|
+
)
|
|
73
|
+
attributes = attributes.at[:, k].set(
|
|
74
|
+
jnp.where(zero_mask, new_attr, attributes[:, k])
|
|
75
|
+
)
|
|
76
|
+
|
|
77
|
+
return multiplicity, attributes
|
|
78
|
+
|
|
79
|
+
return body
|
|
80
|
+
|
|
81
|
+
def collision_coalescence(
|
|
82
|
+
self,
|
|
83
|
+
*,
|
|
84
|
+
multiplicity,
|
|
85
|
+
idx,
|
|
86
|
+
attributes,
|
|
87
|
+
gamma,
|
|
88
|
+
healthy, # pylint: disable=unused-argument
|
|
89
|
+
cell_id, # pylint: disable=unused-argument
|
|
90
|
+
coalescence_rate, # pylint: disable=unused-argument
|
|
91
|
+
is_first_in_pair,
|
|
92
|
+
# TODO #1913: implement rates, multi-cell collisions and healthy
|
|
93
|
+
):
|
|
94
|
+
multiplicity.data, attributes.data = self._collision_coalescence_body(
|
|
95
|
+
multiplicity.data,
|
|
96
|
+
idx.data,
|
|
97
|
+
attributes.data,
|
|
98
|
+
gamma.data,
|
|
99
|
+
is_first_in_pair.indicator.data,
|
|
100
|
+
)
|
|
101
|
+
multiplicity.data.block_until_ready()
|
|
102
|
+
|
|
103
|
+
@cached_property
|
|
104
|
+
def _compute_gamma_body(self):
|
|
105
|
+
def body(prob, rand, idx, multiplicity, is_first_in_pair, i):
|
|
106
|
+
out = jnp.ceil(prob[i] - rand[i])
|
|
107
|
+
offset = 1 - is_first_in_pair[2 * i]
|
|
108
|
+
j = idx[2 * i + offset]
|
|
109
|
+
k = idx[2 * i + 1 + offset]
|
|
110
|
+
|
|
111
|
+
prop = multiplicity[j] // multiplicity[k]
|
|
112
|
+
return jnp.minimum(out.astype(int), prop)
|
|
113
|
+
|
|
114
|
+
return jax.jit(jax.vmap(body, (None, None, None, None, None, 0)))
|
|
115
|
+
|
|
116
|
+
def compute_gamma(
|
|
117
|
+
self,
|
|
118
|
+
*,
|
|
119
|
+
prob,
|
|
120
|
+
rand,
|
|
121
|
+
multiplicity,
|
|
122
|
+
cell_id, # pylint: disable=unused-argument
|
|
123
|
+
collision_rate_deficit, # pylint: disable=unused-argument
|
|
124
|
+
collision_rate, # pylint: disable=unused-argument
|
|
125
|
+
is_first_in_pair,
|
|
126
|
+
out,
|
|
127
|
+
# TODO #1913: implement rates, multi-cell collisions and healthy
|
|
128
|
+
):
|
|
129
|
+
indices = jnp.arange(len(multiplicity) // 2)
|
|
130
|
+
out.data = self._compute_gamma_body(
|
|
131
|
+
prob.data,
|
|
132
|
+
rand.data,
|
|
133
|
+
multiplicity.idx.data,
|
|
134
|
+
multiplicity.data,
|
|
135
|
+
is_first_in_pair.indicator.data,
|
|
136
|
+
indices,
|
|
137
|
+
).block_until_ready()
|
|
138
|
+
|
|
139
|
+
@staticmethod
|
|
140
|
+
def make_cell_caretaker(
|
|
141
|
+
idx_shape, idx_dtype, cell_start_len, scheme="default"
|
|
142
|
+
): # pylint: disable=unused-argument
|
|
143
|
+
# cell_start_len present for API compliance
|
|
144
|
+
class CellCaretaker: # pylint: disable=too-few-public-methods
|
|
145
|
+
def __init__(self, idx_shape, idx_dtype, scheme):
|
|
146
|
+
assert scheme == "default"
|
|
147
|
+
self.tmp_idx = Storage.empty(idx_shape, idx_dtype)
|
|
148
|
+
|
|
149
|
+
def __call__(self, cell_id, cell_idx, cell_start, idx):
|
|
150
|
+
length = len(idx)
|
|
151
|
+
cell_start.data = (
|
|
152
|
+
CollisionsMethods._counting_sort_by_cell_id_and_update_cell_start(
|
|
153
|
+
self.tmp_idx.data,
|
|
154
|
+
idx.data,
|
|
155
|
+
cell_id.data,
|
|
156
|
+
cell_idx.data,
|
|
157
|
+
length,
|
|
158
|
+
cell_start.data,
|
|
159
|
+
)
|
|
160
|
+
)
|
|
161
|
+
|
|
162
|
+
return CellCaretaker(idx_shape, idx_dtype, scheme)
|
|
163
|
+
|
|
164
|
+
@cached_property
|
|
165
|
+
def _normalize_body(self):
|
|
166
|
+
@jax.jit
|
|
167
|
+
def body(prob, cell_start, timestep, dv):
|
|
168
|
+
sd_num = cell_start[1] - cell_start[0]
|
|
169
|
+
|
|
170
|
+
def loop_body(i, prob):
|
|
171
|
+
norm_factor = (sd_num >= 2) * (
|
|
172
|
+
timestep / dv * sd_num * (sd_num - 1) / 2 / (sd_num // 2)
|
|
173
|
+
)
|
|
174
|
+
prob = prob.at[i].multiply(norm_factor)
|
|
175
|
+
return prob
|
|
176
|
+
|
|
177
|
+
return jax.lax.fori_loop(0, prob.shape[0], loop_body, prob)
|
|
178
|
+
|
|
179
|
+
return body
|
|
180
|
+
|
|
181
|
+
# pylint: disable=too-many-arguments,disable=unused-argument
|
|
182
|
+
def normalize(self, prob, cell_id, cell_idx, cell_start, norm_factor, timestep, dv):
|
|
183
|
+
prob.data = self._normalize_body(
|
|
184
|
+
prob.data, cell_start.data, timestep, dv
|
|
185
|
+
).block_until_ready()
|
|
186
|
+
|
|
187
|
+
@staticmethod
|
|
188
|
+
# pylint: disable=too-many-arguments
|
|
189
|
+
def _counting_sort_by_cell_id_and_update_cell_start(
|
|
190
|
+
new_idx, # pylint: disable=unused-argument
|
|
191
|
+
idx, # pylint: disable=unused-argument
|
|
192
|
+
cell_id, # pylint: disable=unused-argument
|
|
193
|
+
cell_idx, # pylint: disable=unused-argument
|
|
194
|
+
length, # pylint: disable=unused-argument
|
|
195
|
+
cell_start, # pylint: disable=unused-argument
|
|
196
|
+
):
|
|
197
|
+
# TODO #1913: implement sorting
|
|
198
|
+
cell_start = cell_start.at[0].set(0)
|
|
199
|
+
return cell_start
|