Solvophobically Driven Complexation of Adamantyl Mannoside with β-Cyclodextrin in Water and Structured Organic Solvents.
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Solvophobically Driven Complexation of Adamantyl Mannoside with β-Cyclodextrin in Water and Structured Organic Solvents.

Leko, Katarina;Hanževački, Marko;Brkljača, Zlatko;Pičuljan, Katarina;Ribić, Rosana;Požar, Josip;
Chemistry (Weinheim an der Bergstrasse, Germany) 2020 Vol. 26 pp. 5104
232
leko2020solvophobicallychemistry

Abstract

Invited for the cover of this issue is Josip Požar with collaborators from the University of Zagreb. The image depicts the differences in high- and low-temperature water effect on the complexation thermodynamics of adamantyl mannoside with β-cyclodextrin. Read the full text of the article at 10.1002/chem.202000282.

Keywords

molecular docking molecular dynamics simulations structure based virtual screening thermodynamics of protein-ligand interactions

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DOI:
10.1002/chem.202000850

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