scholarly journals 1H and13C NMR Studies of Formation and Molecular Dynamics of Methylated-Cyclodextrin Inclusion Complexes with Phenylalanine

1987 ◽  
Vol 60 (7) ◽  
pp. 2539-2545 ◽  
Author(s):  
Yoshio Inoue ◽  
Fu-Hua Kuan ◽  
Riichiro Chûjô
Keyword(s):  
Molecular Dynamics ◽  
Inclusion Complexes ◽  
Nmr Studies ◽  
1H And13c Nmr ◽  
Cyclodextrin Inclusion Complexes ◽  
Cyclodextrin Inclusion ◽  
Methylated Cyclodextrin

IR, UV and NMR studies of β-cyclodextrin inclusion complexes of kazcaine and prosidol bases

2010 ◽  
Vol 69 (1-2) ◽  
pp. 181-190 ◽  
Author(s):  
U. Kemelbekov ◽  
Y. Luo ◽  
Z. Orynbekova ◽  
Zh. Rustembekov ◽  
R. Haag ◽  
...  
Keyword(s):  
Inclusion Complexes ◽  
Nmr Studies ◽  
Cyclodextrin Inclusion Complexes ◽  
Cyclodextrin Inclusion

scholarly journals Metadynamics supports molecular dynamics simulation-based binding affinities of eucalyptol and beta-cyclodextrin inclusion complexes

RSC Advances ◽  
2017 ◽  
Vol 7 (80) ◽  
pp. 50899-50911 ◽  
Author(s):  
Bodee Nutho ◽  
Nadtanet Nunthaboot ◽  
Peter Wolschann ◽  
Nawee Kungwan ◽  
Thanyada Rungrotmongkol
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Inclusion Complexes ◽  
Dynamics Simulation ◽  
Binding Affinities ◽  
Cyclodextrin Inclusion Complexes ◽  
Beta Cyclodextrin ◽  
Cyclodextrin Inclusion ◽  
Simulation Based ◽  
Molecular Dynamics Methods

The development of various molecular dynamics methods enables the detailed investigation of association processes, like host–guest complexes, including their dynamics and, additionally, the release of the guest compound.

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