Performance of Localized-Orbital Coupled-Cluster Approaches for the Conformational Energies of Longer <i>n</i>-Alkane Chains-Reference-Cited by-同舟云学术

Performance of Localized-Orbital Coupled-Cluster Approaches for the Conformational Energies of Longer n-Alkane Chains

Published:2022-12-12 Issue:50 Volume:126 Page:9375-9391
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Santra Golokesh¹^ORCID,Martin Jan M.L.¹^ORCID

Affiliation:

1. Department of Molecular Chemistry and Materials Science, Weizmann Institute of Science, 7610001Reḥovot, Israel

Funder

Israel Science Foundation

Feinberg Graduate School, Weizmann Institute of Science

Minerva Foundation

Artificial Intelligence and Smart Materials Research Fund

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c06407

Reference114 articles.

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2. The Protein Folding Problem

3. Conformational change in substrate binding, catalysis and product release: an open and shut case?

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