LinkTW and LinkTWM Programs for computing Linking numbers, Twist and Writhe for cyclic annulenes.

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Rzepa, Henry S.;Rappaport, Shay

Description

Higher twisted (Möbius) annulenes can be characterised by topological invariants such as the linking number Lk and related by the Cãlugãreanu/Fuller theorem to twist and writhe by the expression Lk = Tw + Wr Programs to compute these properties are available here. The source codes are LinkTW.cpp and LinkTWM.cpp. The former code should be used for systems with an even linking number and the latter for systems with an odd linking number. The file Calculus.cpp, is also needed.

Citations (1)

Mentions (0)

Metrics

Dataset Index

0.9

FAIR Score

85%

Citations

1

Mentions

0

Metrics Over Time

Publication Details

DOI

Publisher

figshare

Assigned Domain

Subfield

Artificial Intelligence

Field

Computer Science

Domain

Physical Sciences

Confidence Score

77%

Source

Open Alex

Keywords

Computational Chemistry

Normalization Factors

FT

13.46

CTw

1.00

MTw

1.00