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Scientific Reports|July 20, 2018
Electrostatic Tuning of the Ligand Binding Mechanism by Glu27 in Nitrophorin 7Stefania Abbruzzetti, Alessandro Allegri, Axel Bidon-Chanal, et al.European Journal of Medicinal Chemistry|June 20, 2014
Molecular basis of the selective binding of MDMA enantiomers to the alpha4beta2 nicotinic receptor subtype: synthesis, pharmacological evaluation and mechanistic studiesSalomé Llabrés, Sara García-Ratés, Edgar Cristóbal-Lecina, et al.Journal of Chemical Information and Computer Sciences|November 24, 2004
Design and characterization of libraries of molecular fragments for use in NMR screening against protein targetsNicolas Baurin, Fareed Aboul-Ela, Xavier Barril, et al.Plos Computational Biology|April 12, 2014
rDock: a fast, versatile and open source program for docking ligands to proteins and nucleic acidsSergio Ruiz-Carmona, Daniel Alvarez-Garcia, Nicolas Foloppe, et al.Bioorganic Chemistry|February 26, 2022
Revealing 2-dimethylhydrazino-2-alkyl alkynyl sphingosine derivatives as sphingosine kinase 2 inhibitors: Some hints on the structural basis for selective inhibitionMacarena Corro-Morón, Albert Granell, Varbina Ivanova, et al.Journal of Medicinal Chemistry|October 26, 2011
Synthesis, biological evaluation, and molecular modeling of donepezil and N-[(5-(benzyloxy)-1-methyl-1H-indol-2-yl)methyl]-N-methylprop-2-yn-1-amine hybrids as new multipotent cholinesterase/monoamine oxidase inhibitors for the treatment of Alzheimer's diseaseIrene Bolea, Jordi Juárez-Jiménez, Cristóbal de Los Ríos, et al.Journal of Dairy Science|December 4, 2014
The complex of hypericin with β-lactoglobulin has antimicrobial activity with potential applications in dairy industryBeatriz Rodríguez-Amigo, Pietro Delcanale, Gabriel Rotger, et al.Organic Letters|July 22, 2017
Enantioselective Synthesis of Spiro[indolizidine-1,3'-oxindoles]Maria Pérez, Carlos Ramos, Lucia Massi, et al.The Journal of Physical Chemistry. B|October 10, 2009
Ab initio study of the structural, tautomeric, pairing, and electronic properties of seleno-derivatives of thymineAlvaro Vázquez-Mayagoitia, Oscar Huertas, Giorgia Brancolini, et al.ACS Medicinal Chemistry Letters|November 17, 2022
Inhibition of β-Amyloid Aggregation in Alzheimer's Disease: The Key Role of (Pro)electrophilic WarheadsFilippo Basagni, Marina Naldi, Tiziana Ginex, et al.Pageof 28