PulseExploreJournal ClubDebatesTrendingResearchersJournals
Instagram
HomeExploreJournal ClubTrending
Synapse
⌘+K
Synapse
January 1, 2021Revue Roumaine de Chimie11 citations

Program for prediction dihedral angle from vicinal coupling constant with 3-sphere approach

View Full Paper
EBEmerich BarthaCMCarmen‐Irena MitanCDConstantin Drăghici

Key Points

Key points are not available for this paper at this time.

Abstract

3-Sphere approach is applied on prediction dihedral angle θHnHn+1deg only from vicinal coupling constant 3JHnHn+1Hz with Java script, in comparation with angles calculated from the differences between two atoms of carbon chemical shift (ΔδCnCn+1ppm) and Karplus equations. The trigonometric equations 1, 2 ensuring the right sign along the D-, L series rule.

Ask AI
Helpful
Bookmark
Share
View Full Paper

Cite This Study

Bartha et al. (2021) studied this question.

synapsesocial.com/papers/6a8336d7d7df55868faf904dhttps://doi.org/10.33224/rrch.2021.66.2.08
Ask AI
Helpful
Bookmark
Share
View Full Paper