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deepmodeling / dpgen2

2nd generation of the Deep Potential GENerator
https://docs.deepmodeling.com/projects/dpgen2/
GNU Lesser General Public License v3.0
33 stars 25 forks source link

Refactor finetune #247

Closed zjgemi closed 2 months ago

zjgemi commented 3 months ago

Summary by CodeRabbit

coderabbitai[bot] commented 3 months ago
Walkthrough ## Walkthrough The recent updates to the `dpgen2` project simplify finetuning management and parameter handling by eliminating the explicit finetuning step and integrating it into existing workflows. This streamlining enhances maintainability, reduces complexity in training command generation, and improves the handling of optional parameters across various modules, ultimately leading to clearer and more efficient code. ## Changes | Files/Directories | Change Summary | |-----------------------------------------------------|------------------------------------------------------------------------------------------------------------| | `dpgen2/entrypoint/submit.py` | Removed `make_finetune_step` and integrated finetuning into `workflow_concurrent_learning`, updating return values to streamline the workflow. | | `dpgen2/flow/dpgen_loop.py` | Added `make_next_optional_parameter` to consistently set `finetune_mode` to "no" during scheduling. | | `dpgen2/op/run_dp_train.py` | Simplified model initialization logic by removing redundant checks, clarifying conditions for model training. | | `dpgen2/superop/prep_run_dp_train.py` | Removed `ModifyTrainScript` class and related methods, simplifying the `PrepRunDPTrain` class and its parameter handling. | | `dpgen2/utils/dflow_query.py` | Eliminated checks for "finetune" patterns, streamlining key identification logic in regex functions. | | `tests/mocked_ops.py` | Removed `MockedModifyTrainScript` class and its `execute` method, simplifying test structure and dependencies. | | `tests/test_prep_run_dp_train.py` | Removed tests for `ModifyTrainScript`, refocusing on `MockedPrepDPTrain` and `MockedRunDPTrain`, simplifying the test suite. | | `tests/utils/test_dflow_query.py` | Removed "finetune" entries from `dpgen_keys` and associated test cases, streamlining expected outputs. | ## Sequence Diagram(s) ```mermaid sequenceDiagram participant User participant Workflow participant Model User->>Workflow: Start Training Workflow->>Model: Initialize Model alt Finetuning Enabled Model->>Workflow: Check finetune parameters Workflow->>Model: Set to finetune mode end Workflow->>Model: Execute Training Model->>Workflow: Training Results Workflow->>User: Return Results ```
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Commits Files that changed from the base of the PR and between 33bac052293c737cb48dd7db06e8c90510a223f4 and ef494e90bc94a24209222ab18af8480ac9418bb0.
Files selected for processing (2) * dpgen2/op/run_dp_train.py (2 hunks) * tests/op/test_run_dp_train.py (5 hunks)
Files skipped from review as they are similar to previous changes (2) * dpgen2/op/run_dp_train.py * tests/op/test_run_dp_train.py
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codecov[bot] commented 3 months ago

Codecov Report

Attention: Patch coverage is 72.72727% with 3 lines in your changes missing coverage. Please review.

Project coverage is 83.75%. Comparing base (f5c5d95) to head (ef494e9).

Files Patch % Lines
dpgen2/entrypoint/submit.py 40.00% 3 Missing :warning:
Additional details and impacted files ```diff @@ Coverage Diff @@ ## master #247 +/- ## ========================================== - Coverage 83.84% 83.75% -0.10% ========================================== Files 97 97 Lines 5368 5318 -50 ========================================== - Hits 4501 4454 -47 + Misses 867 864 -3 ```

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