Pregled Radovi istraživača / Researchers' publications tema: "Molecular dynamics"
Prikaz rezultata 1-12 od 12
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Conformational mobility of active and E-64-inhibited actinidin
(Elsevier, 2013) -
Potential Energy Surface Evaluation and Fitting
(Elsevier, 2015) -
Structural modifications of 4-aryl-4-oxo-2-aminylbutanamides and their acetyl- and butyrylcholinesterase inhibitory activity. Investigation of AChE-ligand interactions by docking calculations and molecular dynamics simulations
(Elsevier France-Editions Scientifiques Medicales Elsevier, Paris, 2014) -
Structural modifications of 4-aryl-4-oxo-2-aminylbutanamides and their acetyl- and butyrylcholinesterase inhibitory activity. Investigation of AChE-ligand interactions by docking calculations and molecular dynamics simulations
(Elsevier France-Editions Scientifiques Medicales Elsevier, Paris, 2014) -
Theoretical insight into sulfur aromatic interactions with extension to D-2 receptor activation mechanism
(Springer/Plenum Publishers, New York, 2015)