ideal_mols_2

Cook, Cameron

Description

This is the csv file for the ideal_mols_2 dataset outputted by the brute force algorithm. It contains around 8.4 million molecules, with their 1st and 2nd transition energies and oscillator strengths and SA score predictions.

Citations (0)

Mentions (0)

Metrics

Dataset Index

0.6

FAIR Score

85%

Citations

0

Mentions

0

Metrics Over Time

Publication Details

DOI

Publisher

figshare

License

Apache 2.0

Assigned Domain

Subfield

Organic Chemistry

Field

Chemistry

Domain

Physical Sciences

Confidence Score

39%

Source

Scholar Data Model

Keywords

Organic chemistry not elsewhere classified

Normalization Factors

FT

50.00

CTw

1.00

MTw

1.00