Molecular Modeling of Hydrogen Bonding Fluids: Phase Behavior of Industrial Fluids

2012 ◽  
pp. 567-579
Author(s):  
Stefan Eckelsbach ◽  
Martin Bernreuther ◽  
Cemal Engin ◽  
Gabriela Guevara-Carrion ◽  
Yow-Lin Huang ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Molecular Modeling ◽  
Phase Behavior

Hydrogen Bonding Models: Their Relevance to Molecular Modeling

1996 ◽  
pp. 119-141 ◽  
Author(s):  
Paola Gilli ◽  
Valeria Ferretti ◽  
Gastone Gilli
Keyword(s):  
Hydrogen Bonding ◽  
Molecular Modeling

Closed-Loop Phase Behavior of Block Copolymers in the Presence of Competitive Hydrogen-Bonding and Coulombic Interaction

2018 ◽  
Vol 51 (12) ◽  
pp. 4727-4734 ◽  
Author(s):  
Rui-Yang Wang ◽  
Jie Huang ◽  
Xiao-Shuai Guo ◽  
Xiao-Han Cao ◽  
Shu-Fen Zou ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Block Copolymers ◽  
Phase Behavior ◽  
Closed Loop ◽  
Coulombic Interaction

scholarly journals Sugar-derived oxazolone pseudotetrapeptide as γ-turn inducer and anion-selective transporter

2019 ◽  
Vol 15 ◽  
pp. 2419-2427
Author(s):  
Sachin S Burade ◽  
Sushil V Pawar ◽  
Tanmoy Saha ◽  
Navanath Kumbhar ◽  
Amol S Kotmale ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Amino Acid ◽  
Molecular Modeling ◽  
Intramolecular Cyclization ◽  
Membered Ring ◽  
Conformational Study ◽  
Oxazole Ring ◽  
Solution State ◽  
Modeling Studies ◽  
Molecular Modeling Studies

The intramolecular cyclization of a C-3-tetrasubstituted furanoid sugar amino acid-derived linear tetrapeptide afforded an oxazolone pseudo-peptide with the formation of an oxazole ring at the C-terminus. A conformational study of the oxazolone pseudo-peptide showed intramolecular C=O···HN(II) hydrogen bonding in a seven-membered ring leading to a γ-turn conformation. This fact was supported by a solution-state NMR and molecular modeling studies. The oxazolone pseudotetrapeptide was found to be a better Cl−-selective transporter for which an anion–anion antiport mechanism was established.

Interplay between Hydrogen Bonding and Macromolecular Architecture Leading to Unusual Phase Behavior in Thermosensitive Microgels

2008 ◽  
Vol 120 (2) ◽  
pp. 344-347 ◽  
Author(s):  
Martina Keerl ◽  
Vytautas Smirnovas ◽  
Roland Winter ◽  
Walter Richtering
Keyword(s):  
Hydrogen Bonding ◽  
Phase Behavior ◽  
Macromolecular Architecture ◽  
Thermosensitive Microgels

Hydrogen bonding and the phase behavior of rod/coil mixtures

1994 ◽  
Vol 84 (1) ◽  
pp. 315-324 ◽  
Author(s):  
Wei-Long Tang ◽  
Michael M. Coleman ◽  
Paul C. Painter
Keyword(s):  
Hydrogen Bonding ◽  
Phase Behavior
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