ChemTS icon indicating copy to clipboard operation
ChemTS copied to clipboard

How to use MCTS to generate molecules

Open 1121091694 opened this issue 2 years ago • 0 comments

Nice Paper!I have two questions:

  1. Could you plz tell me how to De No generate molecules from MCTS, and RNN is enough why we need MCTS?
  2. **scores.csv in mcts_logp_improved_version: how could we get them? Thanks a lot!

1121091694 avatar Oct 11 '22 12:10 1121091694