Solvation effects on alanine dipeptide: A MP2/cc-pVTZ//MP2/6-31G** study of (?, ?) energy maps and conformers in the gas phase, ether, and water
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Reference61 articles.
1. Theoretical study of blocked glycine and alanine peptide analogs
2. Local geometry maps and conformational transitions between low-energy conformers of N-acetyl-N′-methyl glycine amide: An ab initio study at the 4–21g level with gradient relaxed geometries
3. Conformations of the glycine dipeptide
4. Ab initio studies of molecular geometries. 27. Optimized molecular structures and conformational analysis of N.alpha.-acetyl-N-methylalaninamide and comparison with peptide crystal data and empirical calculations
5. 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
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