Benchmarking the ability of GFB1-xTB to determine relative energies of conformers in small organic molecules

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Terets, Andrii;Nikolaienko, Tymofii

Description

No description available.

Citations (0)

Mentions (0)

Metrics

Dataset Index

1.6

FAIR Score

73%

Citations

0

Mentions

0

Metrics Over Time

Publication Details

DOI

Publisher

Zenodo

Assigned Domain

Subfield

Physical and Theoretical Chemistry

Field

Chemistry

Domain

Physical Sciences

Confidence Score

93%

Source

Open Alex

Normalization Factors

FT

15.38

CTw

1.00

MTw

1.00