𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Configuration entropy of the alanine dipeptide in vacuum and in solution: a molecular dynamics study

✍ Scribed by Brady, John; Karplus, Martin


Book ID
126140849
Publisher
American Chemical Society
Year
1985
Tongue
English
Weight
350 KB
Volume
107
Category
Article
ISSN
0002-7863

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Molecular Dynamics Study of the Thermal
✍ Karl Jug; Nisanth N. Nair; Igor P. Gloriozov πŸ“‚ Article πŸ“… 2006 πŸ› John Wiley and Sons βš– 8 KB

## Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract, please click on HTML or PDF.

Molecular dynamics simulation in vacuo a
✍ Michele Saviano; Misako Aida; Giorgina Corongiu πŸ“‚ Article πŸ“… 1991 πŸ› Wiley (John Wiley & Sons) 🌐 English βš– 608 KB

## Abstract The conformation of cyclolinopeptide A [c‐(Pro‐Pro‐Phe‐Phe‐Leu‐Ile‐Ile‐Leu‐Val)], a naturally occurring peptide with remarkable cytoprotective activity, has been investigated by means of molecular dynamics simulations in various molecular environments. Structural and dynamical propertie

Quantum mechanical study of the conforma
✍ Caterina Benzi; Roberto Improta; Giovanni Scalmani; Vincenzo Barone πŸ“‚ Article πŸ“… 2002 πŸ› John Wiley and Sons 🌐 English βš– 218 KB

## Abstract The conformational behavior of the title compounds has been investigated by Hartree–Fock, MP2, and DFT computations on the most significant structures related to variations of the backbone dihedral angles, cis/trans isomerism around the peptide bond, and diastereoisomeric puckering of t