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test AUC

Status: Open.

#359 In deepmodeling/Uni-Mol;

· mxqmxqmxq opened on Sep 3, 2025

[BUG] wrong pose in unimol docking v2

bugSomething isn't workingSomething isn't working

Status: Open.

#358 In deepmodeling/Uni-Mol;

· yangjinhao1234 opened on Aug 21, 2025

[BUG] total_train_steps was not calculated or passed in correctly

bugSomething isn't workingSomething isn't working

Status: Open.

#357 In deepmodeling/Uni-Mol;

· jia-huang opened on Aug 14, 2025

[BUG] _RuntimeError: p.is_cuda() INTERNAL ASSERT FAILED at "/home/runner/work/Uni-Core/Uni-Core/csrc/adam/interface.cpp":10, please report a bug to PyTorch. p must be a CUDA tensor

bugSomething isn't workingSomething isn't working

Status: Open.

#356 In deepmodeling/Uni-Mol;

· jia-huang opened on Aug 11, 2025

[Feature Request] _Replace with Title_Toxcast multi-label task property prediction

enhancementNew feature or requestNew feature or request

Status: Open.

#355 In deepmodeling/Uni-Mol;

· 3505675604 opened on Jul 23, 2025

[BUG] the saved model only have parameters of classification head

bugSomething isn't workingSomething isn't working

Status: Open.

#354 In deepmodeling/Uni-Mol;

· kevin-wen1 opened on Jul 14, 2025

UniMol_Docking_v2: input_protein column should not be in input CSV when using batch_one2many

documentationImprovements or additions to documentationImprovements or additions to documentation

Status: Open.

#353 In deepmodeling/Uni-Mol;

· tompan-123 opened on Jul 11, 2025

Question about pre-trained ligand embeddings by Unimol tools

wontfixThis will not be worked onThis will not be worked on

Status: Open.

#351 In deepmodeling/Uni-Mol;

· srdjan125 opened on Jul 9, 2025

[BUG] unimol2 LMDBDataset传的tmp_data_dir参数temp找不到

bugSomething isn't workingSomething isn't working

Status: Open.

#350 In deepmodeling/Uni-Mol;

· zjp0803 opened on Jul 9, 2025

[BUG] unimol+: RuntimeError: Expected all tensors to be on the same device, but found at least two devices, cuda:{0,1,2,3} and cpu!

bugSomething isn't workingSomething isn't working

Status: Open.

#348 In deepmodeling/Uni-Mol;

· Linus-XZX opened on Jun 17, 2025

[Feature Request] _Replace with Title_

enhancementNew feature or requestNew feature or request

Status: Open.

#346 In deepmodeling/Uni-Mol;

· zjp0803 opened on May 22, 2025

[BUG] AttributeError: 'Trainer' object has no attribute 'scaler'

bugSomething isn't workingSomething isn't working

Status: Open.

#343 In deepmodeling/Uni-Mol;

· PatWalters opened on May 11, 2025