Molecular Dynamics Simulation Study of 18-Crown-6 in Aqueous Solution. 2. Free Energy Profile for the Association 18C6.cntdot. .cntdot. .cntdot.K+ in Water-Reference-Cited by-同舟云学术

Molecular Dynamics Simulation Study of 18-Crown-6 in Aqueous Solution. 2. Free Energy Profile for the Association 18C6.cntdot. .cntdot. .cntdot.K+ in Water

Published:1995-04 Issue:15 Volume:99 Page:5240-5246
ISSN:0022-3654
Container-title:The Journal of Physical Chemistry
language:en
Short-container-title:J. Phys. Chem.

Author:

Kowall Thomas,Geiger Alfons

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,General Engineering

Link

https://pubs.acs.org/doi/pdf/10.1021/j100015a003

Cited by 26 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Extraction of Gd3+ and UO22+ Ions Using Polystyrene Grafted Dibenzo Crown Ether (DB18C6) with Octanol and Nitrobenzene: A Molecular Dynamics Study;The Journal of Physical Chemistry B;2018-01-16

2. Molecular dynamics simulations of 18-crown-6 aqueous solutions;Journal of Molecular Liquids;2016-12

3. Quantum mechanical calculations of the interactions between diazacrowns and the sodium cation: an insight into Na+ complexation in diazacrown-based synthetic ion channels;RSC Adv.;2015

4. Complex Formation of Crown Ethers and Cations in Water–Organic Solvent Mixtures: Part XI. Effects of the Preferential Solvation of Benzo-15-Crown-5 and Acid-Base Properties of the Mixtures on the Thermodynamic Functions for Complex Formation of Benzo-15-Crown-5 with Na+ in Propan-1-ol–Water Mixtures at 298.15 K;Journal of Solution Chemistry;2009-09-02

5. Protein−Ligand Binding Free Energy Calculation by the Smooth Reaction Path Generation (SRPG) Method;Journal of Chemical Information and Modeling;2009-07-29