ChemInform Abstract: New Terpenoid Hosts for Chiral Recognition: Crystal Structure and Molecular Modeling Study of an Inclusion Complex with (S)-(+)- Phenyloxirane

Enantioseparation of new triadimenol antifungal active compounds by electrokinetic chromatography and molecular modeling study of chiral recognition mechanisms

Electrophoresis ◽

10.1002/elps.201300607 ◽

2014 ◽

Vol 35 (19) ◽

pp. 2855-2862 ◽

Cited By ~ 5

Author(s):

Wuhong Li ◽

Liang Zhao ◽

Hai Zhang ◽

Xiaofei Chen ◽

Si Chen ◽

...

Keyword(s):

Molecular Modeling ◽

Chiral Recognition ◽

Electrokinetic Chromatography ◽

Active Compounds ◽

Molecular modeling study of Lamotrigine/β-cyclodextrin inclusion complex

Journal of Molecular Liquids ◽

10.1016/j.molliq.2010.11.011 ◽

2011 ◽

Vol 158 (2) ◽

pp. 151-158 ◽

Cited By ~ 32

Author(s):

Lynda Seridi ◽

Ahmed Boufelfel

Keyword(s):

Molecular Modeling ◽

Inclusion Complex ◽

Cyclodextrin Inclusion ◽

Cyclodextrin Inclusion Complex ◽

Molecular modeling study of structures, Hirschfield surface, NBO, AIM, RDG, IGM and 1HNMR of thymoquinone/hydroxypropyl-β-cyclodextrin inclusion complex from QM calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.131565 ◽

2021 ◽

pp. 131565

Author(s):

Kadri Rayenne ◽

Djellala Imane ◽

Bouhadiba Abdelaziz ◽

Nouar Leila ◽

Madi Fatiha ◽

...

Keyword(s):

Molecular Modeling ◽

Inclusion Complex ◽

Cyclodextrin Inclusion ◽

Cyclodextrin Inclusion Complex ◽

Computer-aided molecular modeling study of enantioseparation of iodiconazole and structurally related triadimenol analogues by capillary electrophoresis: Chiral recognition mechanism and mathematical model for predicting chiral separation

Analytica Chimica Acta ◽

10.1016/j.aca.2012.01.007 ◽

2012 ◽

Vol 718 ◽

pp. 138-147 ◽

Cited By ~ 31

Author(s):

Wuhong Li ◽

Guangguo Tan ◽

Liang Zhao ◽

Xiaofei Chen ◽

Xinrong Zhang ◽

...

Keyword(s):

Mathematical Model ◽

Capillary Electrophoresis ◽

Molecular Modeling ◽

Chiral Separation ◽

Chiral Recognition ◽

Recognition Mechanism ◽

Chiral Recognition Mechanism ◽

Computer Aided ◽

Chiral Separation of New Triazole Antifungal Active Compounds by Capillary Electrophoresis and Molecular Modeling Study of Chiral Recognition Mechanisms

CHINESE JOURNAL OF ANALYTICAL CHEMISTRY (CHINESE VERSION) ◽

10.3724/sp.j.1096.2012.10961 ◽

2013 ◽

Vol 40 (7) ◽

pp. 1031-1036

Author(s):

Wu-Hong LI ◽

Xin-Rong ZHANG ◽

Si WU ◽

Guang-Guo TAN ◽

Chao-Mei LIU ◽

...

Keyword(s):

Capillary Electrophoresis ◽

Molecular Modeling ◽

Chiral Separation ◽

Chiral Recognition ◽

Active Compounds ◽

Crystal structure and molecular modeling study of N-carbamoylsarcosine amidase Ta0454 from Thermoplasma acidophilum

Journal of Structural Biology ◽

10.1016/j.jsb.2009.11.008 ◽

2010 ◽

Vol 169 (3) ◽

pp. 304-311 ◽

Cited By ~ 13

Author(s):

Hai-Bin Luo ◽

Heping Zheng ◽

Matthew D. Zimmerman ◽

Maksymilian Chruszcz ◽

Tatiana Skarina ◽

...

Keyword(s):

Crystal Structure ◽

Molecular Modeling ◽

Thermoplasma Acidophilum ◽

1H NMR and Molecular Modeling Study on the Inclusion Complex β-Cyclodextrin−Indomethacin

The Journal of Organic Chemistry ◽

10.1021/jo951410m ◽

1996 ◽

Vol 61 (3) ◽

pp. 909-914 ◽

Cited By ~ 60

Author(s):

G. Fronza ◽

A. Mele ◽

E. Redenti ◽

P. Ventura

Keyword(s):

Molecular Modeling ◽

Inclusion Complex ◽

1H Nmr ◽

X-ray Crystal Structure, Partitioning Behavior, and Molecular Modeling Study of Piracetam-Type Nootropics: Insights into the Pharmacophore

Journal of Medicinal Chemistry ◽

10.1021/jm00001a022 ◽

1995 ◽

Vol 38 (1) ◽

pp. 170-179 ◽

Cited By ~ 27

Author(s):

Cosimo Altomare ◽

Saverio Cellamare ◽

Angelo Carotti ◽

Giovanni Casini ◽

Marcello Ferappi ◽

...

Keyword(s):

Crystal Structure ◽

Molecular Modeling ◽

X Ray ◽

Partitioning Behavior ◽

Application of Molecular Modeling Study in Discovery of Various Types of Novel Lead Compounds

SSRN Electronic Journal ◽

10.2139/ssrn.3576518 ◽

2020 ◽

Author(s):

Ankita Agarwal ◽

Rakesh Kumar

Keyword(s):

Molecular Modeling ◽

Lead Compounds ◽

Design of Some New Potent Beta-secretase Inhibitors Based on QSAR and Molecular Modeling Study on a Series of Hydroxyethylamine Derivatives

Letters in Drug Design & Discovery ◽

10.2174/1570180811310030009 ◽

2013 ◽

Vol 10 (3) ◽

pp. 253-265

Author(s):

YashShree Pandey ◽

Satya Prakash Gupta

Keyword(s):

Molecular Modeling ◽

Beta Secretase ◽