Table 1 The test result of generating MOF with target property

From: Property-guided inverse design of metal-organic frameworks using quantum natural language processing

 

Pore Volume

CO2 Henry’s Constant

Target Property

Accuracy [%]

Avg. Guess

Accuracy [%]

Avg. Guess

Low

100

7.71

91

7.23

Mod. Low

100

10.73

81

28.44

Mod. High

91

9.98

98

25.13

High

100

11.76

90

7.33

  1. The accuracy was calculated as the ratio of correct predictions over a total of 100 generation tasks (the number of correct, incorrect, and timeouts was considered).
Back to article page