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Move main-side CHANGELOG entries from [2.1.0] to [2.2.0]
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CHANGELOG.md

Lines changed: 46 additions & 44 deletions
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@@ -10,6 +10,27 @@ and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0
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### Added
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- Adds xDeepONet to experimental models
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(`physicsnemo.experimental.models.xdeeponet.DeepONet`). A single
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dimension-generic (2D/3D) DeepONet that accepts a spatial or MLP branch,
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an optional trunk, and an optional second branch as `nn.Module` inputs
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(dependency injection). Six forward-call conventions cover trunked,
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trunkless, packed/auto-padded, and xFNO-style time-axis-extend modes.
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Supports multi-channel output, multiple decoder types (MLP, Conv,
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temporal projection), composable Fourier / UNet / Conv spatial branches
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(`SpatialBranch`), and coordinate features.
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- Adds `Sin` elementwise sine activation to `physicsnemo.nn`, registered
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in `ACT2FN` so it can be looked up by name (`get_activation("sin")`).
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- Adds active-learning recipe for external-aerodynamics surrogates
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(`examples/cfd/external_aerodynamics/active_learning_aero/`). Iteratively
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fine-tunes a GP-augmented GeoTransolver onto an out-of-distribution
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target class by scoring unlabeled candidates with a joint UQ signal
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(GP-vs-integrated-drag disagreement + GP posterior std) and selecting
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the top-`k` per round. Built on the `physicsnemo.active_learning`
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protocols and `physicsnemo.experimental.uq.VariationalGPHead`, with a
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layered structure (generic AL driver / GP-UQ recipe / aero adapter)
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designed for reuse on other UQ-based regression problems.
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### Changed
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### Deprecated
@@ -18,6 +39,31 @@ and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0
1839

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### Fixed
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- Replaced three plain-string regex / docstring literals containing invalid
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escape sequences with raw-string equivalents
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(`physicsnemo/utils/logging/launch.py`,
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`physicsnemo/metrics/general/calibration.py`,
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`physicsnemo/metrics/general/crps.py`); these were `SyntaxWarning`s today
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and become `SyntaxError`s in Python 3.16.
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- Various test cleanups to remove self-inflicted warnings in CI output:
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disabled pytest collection for `TestModelA`/`TestModelB` helpers in
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`test/core/test_registry.py` via `__test__ = False`; migrated
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`test/nn/module/test_interpolation.py` to call the non-deprecated
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`grid_to_point_interpolation` and added a dedicated test for the
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deprecation alias; scoped a `lr_scheduler.step()`-before-`optimizer.step()`
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`UserWarning` filter to a single test in
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`test/optim/test_combined_optimizer.py`; guarded the
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`DistributedManager.initialize()` calls in `test/utils/test_checkpoint.py`
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with `is_initialized()`; and suppressed the import-time
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`ExperimentalFeatureWarning` in `test/datapipes/healda/test_features.py`
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via `warnings.catch_warnings()`.
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- Fixed `physicsnemo.utils.get_checkpoint_dir` returning paths with `\`
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separators on Windows (e.g. `.\checkpoints_model`), which was inconsistent
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with the `/`-based paths used elsewhere in the checkpoint utilities and
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broke the `test_get_checkpoint_dir` CI test on Windows. The function now
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always joins with `/`, working uniformly for local paths and `fsspec`
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URIs (`msc://`, etc.) across operating systems.
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### Security
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### Dependencies
@@ -26,17 +72,6 @@ and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0
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### Added
2874

29-
- Adds xDeepONet to experimental models
30-
(`physicsnemo.experimental.models.xdeeponet.DeepONet`). A single
31-
dimension-generic (2D/3D) DeepONet that accepts a spatial or MLP branch,
32-
an optional trunk, and an optional second branch as `nn.Module` inputs
33-
(dependency injection). Six forward-call conventions cover trunked,
34-
trunkless, packed/auto-padded, and xFNO-style time-axis-extend modes.
35-
Supports multi-channel output, multiple decoder types (MLP, Conv,
36-
temporal projection), composable Fourier / UNet / Conv spatial branches
37-
(`SpatialBranch`), and coordinate features.
38-
- Adds `Sin` elementwise sine activation to `physicsnemo.nn`, registered
39-
in `ACT2FN` so it can be looked up by name (`get_activation("sin")`).
4075
- Adds GLOBE model (`physicsnemo.experimental.models.globe.model.GLOBE`),
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including new variant that uses a dual tree traversal algorithm to reduce the
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complexity of the kernel evaluations from O(N^2) to O(N).
@@ -46,15 +81,6 @@ and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0
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- Adds concrete dropout uncertainty quantification for GeoTransolver. Learnable
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per-layer dropout rates enable MC-Dropout inference for uncertainty
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estimates. Disabled by default (`concrete_dropout: false`).
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- Adds active-learning recipe for external-aerodynamics surrogates
50-
(`examples/cfd/external_aerodynamics/active_learning_aero/`). Iteratively
51-
fine-tunes a GP-augmented GeoTransolver onto an out-of-distribution
52-
target class by scoring unlabeled candidates with a joint UQ signal
53-
(GP-vs-integrated-drag disagreement + GP posterior std) and selecting
54-
the top-`k` per round. Built on the `physicsnemo.active_learning`
55-
protocols and `physicsnemo.experimental.uq.VariationalGPHead`, with a
56-
layered structure (generic AL driver / GP-UQ recipe / aero adapter)
57-
designed for reuse on other UQ-based regression problems.
5884
- Adds automatic support for `FSDP` and/or `ShardTensor` models in checkpoint save/load
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functionality
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- PhysicsNeMo-Mesh now supports conversion from PyVista/VTK/VTU meshes that may
@@ -282,30 +308,6 @@ and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0
282308

283309
### Fixed
284310

285-
- Replaced three plain-string regex / docstring literals containing invalid
286-
escape sequences with raw-string equivalents
287-
(`physicsnemo/utils/logging/launch.py`,
288-
`physicsnemo/metrics/general/calibration.py`,
289-
`physicsnemo/metrics/general/crps.py`); these were `SyntaxWarning`s today
290-
and become `SyntaxError`s in Python 3.16.
291-
- Various test cleanups to remove self-inflicted warnings in CI output:
292-
disabled pytest collection for `TestModelA`/`TestModelB` helpers in
293-
`test/core/test_registry.py` via `__test__ = False`; migrated
294-
`test/nn/module/test_interpolation.py` to call the non-deprecated
295-
`grid_to_point_interpolation` and added a dedicated test for the
296-
deprecation alias; scoped a `lr_scheduler.step()`-before-`optimizer.step()`
297-
`UserWarning` filter to a single test in
298-
`test/optim/test_combined_optimizer.py`; guarded the
299-
`DistributedManager.initialize()` calls in `test/utils/test_checkpoint.py`
300-
with `is_initialized()`; and suppressed the import-time
301-
`ExperimentalFeatureWarning` in `test/datapipes/healda/test_features.py`
302-
via `warnings.catch_warnings()`.
303-
- Fixed `physicsnemo.utils.get_checkpoint_dir` returning paths with `\`
304-
separators on Windows (e.g. `.\checkpoints_model`), which was inconsistent
305-
with the `/`-based paths used elsewhere in the checkpoint utilities and
306-
broke the `test_get_checkpoint_dir` CI test on Windows. The function now
307-
always joins with `/`, working uniformly for local paths and `fsspec`
308-
URIs (`msc://`, etc.) across operating systems.
309311
- Fixed functional benchmark plot fallback labeling so unlabeled ASV results use
310312
the same key ordering as the benchmark runner.
311313
- Fixed graph break caused by `FunctionSpec` dispatch (`max(key=)` is not supported by `torch.compile`)

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