Chenqqian Zhang

Results 29 comments of Chenqqian Zhang

I have tested the new function and the traj files have been actually merged to a single file . However , I find that the traj folder still exists and...

I tested again and found that the traj empty folder is gone and the unit tests are fine

> > I tested again and found that the traj empty folder is gone and the unit tests are fine > > Where are the unit tests? OK...I found that...

> Please add the parameter to `arginfo.py`. I have added it to 'arginfo.py'. Please check.

I have modified the code and resolved the conflict . Please check.

I think https://github.com/deepmodeling/dpgen/pull/958 can be replaced by this pr. @HuangJiameng

@wanghan-iapcm Different 3D conformations of a molecule have exactly the same label, and each epoch takes one of all 3D conformations of this molecule. Because molecule may only has SMILES,...

@wanghan-iapcm Seemly I do not have the necessary permissions to add reviewers to a pull request in the repository. Can you give me higher access? ![Rjiexf3OdW](https://github.com/deepmodeling/deepmd-kit/assets/100290172/564492a2-d13a-47f8-9236-b521298216fb)

@wanghan-iapcm I have delete all denoise content.