Advanced Monte Carlo simulations of the adsorption of chiral alcohols in a homochiral metal-organic framework

Designing new amine functionalized metal-organic frameworks for carbon dioxide/methane separation

(2013) Zhiwei Qiao et al.   FLUID PHASE EQUILIBRIA

Poly-proline-based chiral stationary phases: A molecular dynamics study of triproline, tetraproline, pentaproline and hexaproline interfaces

(2012) M. Ashtari et al.   JOURNAL OF CHROMATOGRAPHY A

Origin of Enantioselectivity in a Chiral Metal–Organic Framework: A Molecular Simulation Study

(2012) Peyman Z. Moghadam et al.   Journal of Physical Chemistry C

Computational screening of homochiral metal–organic frameworks for enantioselective adsorption

(2011) Xiaoying Bao et al.   MICROPOROUS AND MESOPOROUS MATERIALS

Chiral Separations: Fundamental Review 2010

(2010) Timothy J. Ward et al.   ANALYTICAL CHEMISTRY

Enantioselective Adsorption Characteristics of Aluminum-Substituted MFI Zeolites

(2010) Tom P. Caremans et al.   CHEMISTRY OF MATERIALS

Molecular simulation on the separation of water/ethanol azeotropic mixture by poly(vinyl alcohol) membrane

(2010) Zhiwei Qiao et al.   FLUID PHASE EQUILIBRIA

Parallel tempering Monte Carlo simulations of lysozyme orientation on charged surfaces

(2010) Yun Xie et al.   JOURNAL OF CHEMICAL PHYSICS

Parallel Tempering Simulations of Liquid-Phase Adsorption of n-Alkane Mixtures in Zeolite LTA-5A

(2010) Sudeep Punnathanam et al.   Journal of Physical Chemistry C

Effective Monte Carlo Scheme for Multicomponent Gas Adsorption and Enantioselectivity in Nanoporous Materials

(2010) Titus S. van Erp et al.   Journal of Physical Chemistry Letters

Elucidation of consistent enantioselectivity for a homologous series of chiral compounds in homochiral metal–organic frameworks

(2010) Xiaoying Bao et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Molecular dynamics simulations of the liquid-crystal phases of 2-(4-butyloxyphenyl)-5-octyloxypyrimidine and 5-(4-butyloxyphenyl)-2-octyloxypyrimidine

(2010) R. Pecheanu et al.   PHYSICAL REVIEW E

Collective Effects of Multiple Chiral Selectors on Enantioselective Adsorption

(2009) Xiaoying Bao et al.   LANGMUIR

Palladium-Catalyzed Enantioselective Oxidation of Chiral Secondary Alcohols: Access to Both Enantiomeric Series

(2008) David C. Ebner et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Simulated moving bed chromatography for the separation of enantiomers

(2008) Arvind Rajendran et al.   JOURNAL OF CHROMATOGRAPHY A

Solvation of Phenylglycine- and Leucine-Derived Chiral Stationary Phases: Molecular Dynamics Simulation Study

(2008) Sorin Nita et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A computational study of enantioselective adsorption in a homochiral metal–organic framework

(2008) Xiaoying Bao et al.   MOLECULAR SIMULATION

Hybrid porous solids: past, present, future

(2007) Gérard Férey   CHEMICAL SOCIETY REVIEWS

Template Effects in Porous Coordination Polymers†

(2007) Daisuke Tanaka et al.   CHEMISTRY OF MATERIALS