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Non-Autoregressive Electron Redistribution Modeling for Reaction
  Prediction

Non-Autoregressive Electron Redistribution Modeling for Reaction Prediction

8 June 2021
Hangrui Bi
Hengyi Wang
Chence Shi
Connor W. Coley
Jian Tang
Hongyu Guo
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Papers citing "Non-Autoregressive Electron Redistribution Modeling for Reaction Prediction"

3 / 3 papers shown
Title
Challenging reaction prediction models to generalize to novel chemistry
Challenging reaction prediction models to generalize to novel chemistry
John Bradshaw
Anji Zhang
Babak Mahjour
David E. Graff
Marwin H. S. Segler
Connor W. Coley
47
1
0
11 Jan 2025
ChemAlgebra: Algebraic Reasoning on Chemical Reactions
ChemAlgebra: Algebraic Reasoning on Chemical Reactions
Andrea Valenti
D. Bacciu
Antonio Vergari
OOD
LRM
42
0
0
05 Oct 2022
Permutation invariant graph-to-sequence model for template-free
  retrosynthesis and reaction prediction
Permutation invariant graph-to-sequence model for template-free retrosynthesis and reaction prediction
Zhengkai Tu
Connor W. Coley
35
90
0
19 Oct 2021
1