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European Journal of Medicinal Chemistry|August 19, 2017
Design, synthesis and in vivo study of novel pyrrolidine-based 11β-HSD1 inhibitors for age-related cognitive dysfunctionRosana Leiva, Christian Griñan-Ferré, Constantí Seira, et al.Protein Science : a Publication of the Protein Society|September 17, 2025
Evaluating the protonation state of the catalytic Cys25 in cruzain cysteine protease: A target for Chagas diseaseClauber H S da Costa, Vinícius Bonatto, Hemillin Brenda Teixeira Santos, et al.Angewandte Chemie (International Ed. in English)|November 21, 2025
Water Networks as Hydrophobic Recognition Motifs in ProteinsSerena G Piticchio, Miriam Martínez-Cartró, Salvatore Scaffidi, et al.Plos One|January 12, 2013
CO rebinding kinetics and molecular dynamics simulations highlight dynamic regulation of internal cavities in human cytoglobinMatteo Gabba, Stefania Abbruzzetti, Francesca Spyrakis, et al.Biochimica Et Biophysica Acta|December 3, 2014
Engineered chimeras reveal the structural basis of hexacoordination in globins: a case study of neuroglobin and myoglobinIgnacio Boron, Luciana Capece, Francesca Pennacchietti, et al.Journal of Medicinal Chemistry|June 25, 2005
Novel, potent small-molecule inhibitors of the molecular chaperone Hsp90 discovered through structure-based designBrian W Dymock, Xavier Barril, Paul A Brough, et al.Journal of Medicinal Chemistry|December 13, 2021
Discovery of Novel BRD4 Ligand Scaffolds by Automated Navigation of the Fragment Chemical SpaceSerena G Piticchio, Míriam Martínez-Cartró, Salvatore Scaffidi, et al.Bioorganic & Medicinal Chemistry Letters|February 17, 2006
4-Amino derivatives of the Hsp90 inhibitor CCT018159Xavier Barril, Mandy C Beswick, Adam Collier, et al.Chemmedchem|November 11, 2015
Combined Use of Oligopeptides, Fragment Libraries, and Natural Compounds: A Comprehensive Approach To Sample the Druggability of Vascular Endothelial Growth FactorNúria Bayó-Puxan, Ricard Rodríguez-Mias, Michael Goldflam, et al.Journal of Biomolecular Structure & Dynamics|December 21, 2005
Data mining of molecular dynamics trajectories of nucleic acidsAgnes Noy, Tim Meyer, Manuel Rueda, et al.Pageof 28