deepmd-kit icon indicating copy to clipboard operation
deepmd-kit copied to clipboard

[Feature Request] dpmodel and pt fitting should export several methods

Open njzjz opened this issue 1 year ago • 2 comments

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

njzjz avatar Feb 14 '24 06:02 njzjz

The methods in the linear_atomic_models should be rethink.

wanghan-iapcm avatar Feb 14 '24 08:02 wanghan-iapcm

added in this PR https://github.com/deepmodeling/deepmd-kit/pull/3266/

anyangml avatar Feb 15 '24 03:02 anyangml

The methods in the linear_atomic_models should be rethink.

This will be tracked in #3502 instead.

njzjz avatar May 01 '24 07:05 njzjz