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Packing optimization for automated generation of complex system's initial configurations for molecular dynamics and docking
(John Wiley & Sons IncHobokenEUA, 2003)
Docking and molecular dynamics simulation of quinone compounds with trypanocidal activity
(SPRINGER, 2009)
In this work, two different docking programs were used, AutoDock and FlexX, which use different types of scoring functions and searching methods. The docking poses of all quinone compounds studied stayed in the same region ...
Molecular docking studies of the antitumoral activity and characterization of new chalcone
(BENTHAM SCIENCE PUBLISHERS B.V., 2018)
In silico evidence of direct interaction between statins and β-amyloid
(Wiley-Liss Inc., 2019)
Molecular docking and drug discovery in β-adrenergic receptors
(Bentham Science Publishers B.V., 2017)
Surface pressure-area isotherms for Langmuir monolayers and a docking molecular orientation of perylene tetracarboxylic derivatives on a water surface
(Spectroscopy Soc Canada, Ottawa, 2014)