Predicting the conformational preferences of N-acetyl-4-hydroxy-L-proline- N′-methylamide from the proline residue

Journal of Molecular Structure: THEOCHEM

Volumn 666-667, Issue , 2003, Pages 285-289

  Lam, Janice S W ^a,d   Koo, Joseph C P ^a,c,d   Hudáky, Ilona ^b   Varro, Andras ^c   Papp, Julius Gy ^c   Penke, Botond ^c   Csizmadia, I G ^a,c,d  

^a UNIVERSITY OF TORONTO   (Canada)

^b EÖTVÖS LORÁND UNIVERSITY   (Hungary)

^c UNIVERSITY OF SZEGED   (Hungary)

^d Global Inst Compl Molec Mat Sci   (Canada)

Author keywords

Ab initio; Backbone conformation; Cis trans isomerism; Collagen; Conformer; Density functional geometry optimizations; Hartree Fock; Hydroxyproline; Proline; Ring puckering

Indexed keywords

AMIDE; HYDROXYPROLINE; N ACETYL 4 HYDROXYPROLINE N' METHYLAMIDE; PEPTIDE; PROLINE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; CIS TRANS ISOMERISM; CONFERENCE PAPER; CORRELATION ANALYSIS; GEOMETRY; PREDICTION; PROTEIN ANALYSIS; PROTEIN CONFORMATION; PROTEIN STRUCTURE;

EID: 1642574355     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2003.08.033     Document Type: Conference Paper

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