Skip to main content

Table 3 Atomization energy prediction results

From: Quantum walk neural networks with feature dependent coins

 

RMSE

MAE

GCN

16.51±0.38

12.39±0.29

DCNN

11.90±0.59

8.53±0.42

GAT

18.75±0.51

14.52±1.12

QWNN (cen)

9.70±0.77

6.74±0.24

QWNN (inv)

10.91±0.56

8.28±0.47

  1. The best performing network is in bold