Ab initio studies of structural features not easily amenable to experiment
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference20 articles.
1. Abinitiostudies of structural features not easily amenable to experiment. 23. Molecular structures and conformational analysis of the dipeptideN‐acetyl‐N′‐methyl glycyl amide and the significance of local geometries for peptide structures
2. Conformational transitions and geometry differences between low-energy conformers ofN-acetyl-N′-methyl alanineamide: Anab initiostudy at the 4-21G level with gradient relaxed geometries
3. Predictions of relative structural trends from ab initio derived standard geometry functions
4. Ab-initio studies of structural features not easily amenable to experiment
5. Ab initio studies of structural features not easily amenable to experiment
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1. Density functional study of polypropylene and its submolecules;The Journal of Chemical Physics;1997-05-22
2. Overtone spectroscopy of isobutane at cryogenic temperatures;Chemical Physics;1995-01
3. Structural changes as a function of torsional motion studied by ab initio calculations. Part 2. X2A-AX2 (A = N, P and X = H, F, Cl) and some implications for electron diffraction analysis;Journal of Molecular Structure: THEOCHEM;1993-12
4. Ab initio studies of structural features not easily amenable to experiment;Journal of Molecular Structure: THEOCHEM;1991-11
5. On the use of conformationally dependent geometry trends from ab initio dipeptide and oligopeptide studies in empirical peptide modeling;Journal of Molecular Structure: THEOCHEM;1991-07
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