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30 Open 14 Closed
30 Open 14 Closed
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Issues list

Compare affinity scores for different proteins
#44 opened Jan 8, 2025 by MaximePolicarpo
2
LM embeddings for complex did not have the right length for the protein
#43 opened Jan 7, 2025 by Kimi-Dai
How to Perform Protein-Protein Docking?
#42 opened Dec 19, 2024 by ZZLyna
2
ValueError: Encountered valid chain id that was not present in the LM embeddings
#41 opened Dec 12, 2024 by OlgaKoont
Structural relaxation bug: Several rank structures are not generated with relaxation
#39 opened Nov 26, 2024 by teopopescu
Same protein, same substrate, but with different affinities in docking results
#37 opened Oct 23, 2024 by jinj-github
1
Files for split_train, split_valid, and split_test arguments
#36 opened Oct 20, 2024 by TangYiChing
2
Covalent docking
#35 opened Oct 18, 2024 by Ruibin-Liu
批量对接失败，CUDA_tensor_histogram failed to get free global memory
#34 opened Oct 15, 2024 by wh277
Test example takes forever
#33 opened Aug 31, 2024 by agarrubio
2
Segmentation Faut (core dumped)
#32 opened Aug 30, 2024 by Anupam-5
1
Specifying multiple ligands simultaneously
#31 opened Aug 1, 2024 by faraguna-ginkgo
Results intepretation for HTS ranking
#30 opened Jul 23, 2024 by Le-Phung-Hien
1
RuntimeError: no cross edge found
#29 opened Jul 14, 2024 by zersalsion
Can not run DynamicsBind due to Error
#28 opened Jul 9, 2024 by GM-33
Does the coarse-grained representation remove double/triple bonds in ligands?
#27 opened Jul 7, 2024 by ballaneypranav
1
Movie generation ligand protein clashes
#25 opened Jun 3, 2024 by Jnelen
Could not find the MDT dataset
#23 opened May 18, 2024 by bwang-ecnu
problem: No compatible CUDA device is available
#22 opened May 11, 2024 by CLG68
How to import ligand with "name" column in ligand.csv
#21 opened Apr 23, 2024 by stan1233
4
No such file or directory: 'data/PDBBind_af2_aligned.csv'
#20 opened Apr 7, 2024 by wangjx22
Question of the coordinate difference between the given ".sft/.pdb" files and the original ".sft/.pdb" files
#18 opened Mar 26, 2024 by resistzzz
1
What is the data group "remove" in the given "d3_with_clash_info.csv" file?
#17 opened Mar 26, 2024 by resistzzz
1
ValueError: zero-size array to reduction operation minimum which has no identity
#16 opened Mar 25, 2024 by shafayetrahat
pro_ema_inference_epoch138_model.pt missing
#15 opened Mar 20, 2024 by cjy818github
1
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