RetroPrime icon indicating copy to clipboard operation
RetroPrime copied to clipboard

Code for Single-step Retrosynthesis model Retroprime

Results 6 RetroPrime issues
Sort by recently updated
recently updated
newest added

![image](https://github.com/wangxr0526/RetroPrime/assets/74141246/d87bd3a1-69e4-48c4-89b4-847d667276a1)

Hello! When I run the run_example.sh script, it gives me a FileNotFoundError. Could you please let me know where I can obtain the files USPTO-50K_pos_pred_model_step_90000.pt and USPTO-50K_S2R_model_step_100000.pt? Thank you very...

Hi I am trying to see the results with our dataset when the reaction type is unknown. Therefore, I want to know which parameter is related to reaction type when...

i would like to reproduce the result in the uspto-full dataset, but got some problems here: the accuracy of P2S drops rapidly. i have trained over 50,000 steps and the...

Opening this as more of a note to future readers. The current Anaconda environment setup instructions fail to solve for me and after much experimentation I was able to get...