Computational Data

DOI: 10.14469/hpc/5171 Metadata

Created: 2019-03-27 18:02

Last modified: 2019-08-05 18:20

Author: Charles ROMAIN

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Co-author: Anna Barnard

Description

Computational study: Conformational Analysis of Oligobenzanilides as Multi-Facial α-helix Mimetics

Member of collection / collaboration

DOIDescription
10.14469/hpc/5108 Design, Synthesis and Conformational Analysis of Oligobenzanilides as Multi-Facial alpha-helix Mimetics

Members

DOIDescription
10.14469/hpc/5272 DFT study: Amide Bond Rotation
10.14469/hpc/5294 DFT study: Ar-C(O) rotation
10.14469/hpc/5320 Various DFT Levels
10.14469/hpc/5311 DFT study: Ar-N roation

Associated DOIs

Current dataset ...DOIDescription
References 10.1021/acs.orglett.9b01115 Org Lett publication, Design, Synthesis, and Conformational Analysis of Oligobenzanilides as Multifacial α-Helix Mimetics

Edit