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105 Open 126 Closed
105 Open 126 Closed
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Issues list

Can people put the hardware requirement for running DiffDock?
#265 opened Nov 15, 2024 by starwingc
1
Problem calling inference.py
#264 opened Nov 14, 2024 by xavgit
WARNING -The test dataset did not contain ligand54 and input/7y9b_A_relax.pdb. We are skipping this complex
#263 opened Nov 6, 2024 by YangPH0624
1
Training Details of Diffdock-L
#261 opened Oct 24, 2024 by ShuoAndy
Variation of scores of different runs of inference.py
#260 opened Oct 24, 2024 by sri480673
current limit exceeds maximum limit
#258 opened Oct 18, 2024 by MrGao1997
confusion about the value of confidence
#257 opened Oct 11, 2024 by YangPH0624
1
Program y has been stuck and not responding
#256 opened Oct 10, 2024 by YangPH0624
| #error C++17 or later compatible compiler is required to use ATen.
#255 opened Oct 10, 2024 by YangPH0624
What is OpenFold used for and how to configure energy minimization
#254 opened Oct 8, 2024 by Sue-Fwl
RuntimeError: invalid value in pickle
#253 opened Sep 23, 2024 by ShuoAndy
2
How to dock ligand into active site with the existence of HEME?
#252 opened Sep 21, 2024 by aw10279
Invalid Value Encountered in Sqrt
#250 opened Sep 8, 2024 by navvye
3
RuntimeWarning: invalid value encountered in cast Y = indices.astype(int)
#247 opened Aug 28, 2024 by wxdwxda
2
Parameters of all models
#242 opened Jul 18, 2024 by Endyff
Fail to run multi complexe with csv boolean index did not match indexed array along dimension 0
#240 opened Jul 11, 2024 by AmT42
Error : terminate called after throwing an instance of 'std::system_error'
#239 opened Jul 2, 2024 by makkyle
Logger index error out of range
#238 opened Jun 26, 2024 by srilekha1993
ValueError: No edges and no nodes
#237 opened Jun 22, 2024 by srilekha1993
3
Web UI 'Samples Per Complex' Input Not Reflecting Changes
#235 opened Jun 18, 2024 by pgarrett-scripps
Float division by zero on CUDA memory outage
#234 opened Jun 17, 2024 by Linus-XZX
bfloat16 version of Diffdock
#233 opened Jun 14, 2024 by srilekha1993
Side chains relevance in DiffDock predictions
#232 opened Jun 6, 2024 by juangaropascual
Failed on different complexes for inference.py on CPU and GPU are different for different batch size
#229 opened May 27, 2024 by srilekha1993
4
Installation failed (Openfold, CUDA issues)
#228 opened May 24, 2024 by Moricant
8
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