junsu-kim97 / self_improved_retro Goto Github PK
View Code? Open in Web Editor NEWPyTorch code accompanying the paper "Self-Improved Retrosynthetic Planning" (ICML 2021).
License: MIT License
PyTorch code accompanying the paper "Self-Improved Retrosynthetic Planning" (ICML 2021).
License: MIT License
Hi, I am trying to evaluate a pre-trained model by running the following:
Backward reaction model
python eval_one_step.py
--model_path
${trained_backward_model}
I get an error saying that there is no dataset/raw_rxn/raw_test.csv. I have downloaded all data files listed in the git but don't see that file.
Thank you for sharing the excellent work and codebase! want to ask if the trained models provided in https://drive.google.com/drive/u/0/folders/13DdftEV0x55OZ8ZxHNAkmcvi_4x90hPI lead to the paper results? Thank you!
How many iterations those two models are trained by?
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