deepmd-kit
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[Feature Request] dpmodel and pt fitting should export several methods
Summary
Fitting should add methods to get fparam, aparam, and sel_types.
Detailed Description
Add these methods so the model can get it.
https://github.com/deepmodeling/deepmd-kit/blob/612bedc5da89b468b0c9531c310d2d9671d8b0f5/deepmd/dpmodel/model/dp_atomic_model.py#L147-L162
Further Information, Files, and Links
No response
The methods in the linear_atomic_models should be rethink.
added in this PR https://github.com/deepmodeling/deepmd-kit/pull/3266/
The methods in the linear_atomic_models should be rethink.
This will be tracked in #3502 instead.