๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Insights into the Structure of Large-Ring Cyclodextrins through Molecular Dynamics Simulations in Solution

โœ Scribed by Ivanov, Petko M.; Jaime, Carlos

Book ID
127360145
Publisher
American Chemical Society
Year
2004
Tongue
English
Weight
559 KB
Volume
108
Category
Article
ISSN
0022-3654

No coin nor oath required. For personal study only.

๐Ÿ“œ SIMILAR VOLUMES

New Insights into the Jahnโ€“Teller Effect
New Insights into the Jahnโ€“Teller Effect through ab initio Quantum-Mechanical/Molecular-Mechanical Molecular Dynamics Simulations of CuII in Water
โœ Christian F. Schwenk; Bernd M. Rode ๐Ÿ“‚ Article ๐Ÿ“… 2003 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 260 KB ๐Ÿ‘ 2 views

## Abstract The Cu^II^ hydration shell structure has been studied by means of classical molecular dynamics (MD) simulations including threeโ€body corrections and hybrid quantumโ€mechanical/molecularโ€mechanical (QM/MM) molecular dynamics (MD) simulations at the Hartreeโ€“Fock level. The copper(II) ion i