Comments (2)
These are free bonds where chemical building blocks would attach
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Closing; eventually it may be useful to document how these were generated.
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Related Issues (17)
- version incompatibility causing errors HOT 1
- Clarification for similarity measures HOT 2
- Generated Docking Candidates HOT 1
- Error in Comment Line
- help with running gflownet.py HOT 1
- About the implementation of advantage function in PPO Agent
- About handling parent molecules in samples list
- Difficult to reproduce results listed in the paper HOT 1
- seh_chembl.csv HOT 4
- Want to know the detailed preparation process of dataset HOT 2
- Error: Tensors used as indices must be long, byte or bool tensors HOT 3
- Potential bug with `FlowNetAgent.sample_many` HOT 1
- Reward signal for grid environment? HOT 1
- Do you have the evaluation code? HOT 7
- About Reproducibility Issues HOT 2
- Clarification regarding the number of molecular building blocks. Why they are different from JT-VAE? HOT 3
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