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Journal of the American Chemical Society|May 10, 2007
Dynamical regulation of ligand migration by a gate-opening molecular switch in truncated hemoglobin-N from Mycobacterium tuberculosisAxel Bidon-Chanal, Marcelo A Martí, Darío A Estrin, et al.Proceedings of the National Academy of Sciences of the United States of America|March 14, 2020
Emergence of chromatin hierarchical loops from protein disorder and nucleosome asymmetryAkshay Sridhar, Stephen E Farr, Guillem Portella, et al.Elife|April 27, 2017
Changes in the free-energy landscape of p38α MAP kinase through its canonical activation and binding events as studied by enhanced molecular dynamics simulationsAntonija Kuzmanic, Ludovico Sutto, Giorgio Saladino, et al.Nucleic Acids Research|May 21, 2013
NAFlex: a web server for the study of nucleic acid flexibilityAdam Hospital, Ignacio Faustino, Rosana Collepardo-Guevara, et al.Journal of Chemical Information and Modeling|December 24, 2025
When the Position of Pendant Groups Makes the Difference in G-Quadruplex Behavior: The Case of Bis-Conjugated Thrombin-Binding AptamersChiara Platella, Federica Battistini, Claudia Riccardi, et al.PNAS Nexus|November 20, 2025
Molecular simulations meet personalized medicine: The mechanism of action of CLC-5 antiporter and the origin of Dent's diseaseVeronica Macaluso, Carles Pérez, Robert Soliva, et al.Bioinformatics (Oxford, England)|March 23, 2012
MDWeb and MDMoby: an integrated web-based platform for molecular dynamics simulationsAdam Hospital, Pau Andrio, Carles Fenollosa, et al.Organic Letters|October 6, 2007
Binding affinities of oligonucleotides and PNAs containing phenoxazine and G-clamp cytosine analogues are unusually sequence-dependentJosé-Antonio Ortega, José Ramón Blas, Modesto Orozco, et al.Journal of Chemical Theory and Computation|August 29, 2020
DFFR: A New Method for High-Throughput Recalibration of Automatic Force-Fields for DrugsDavid Moreno, Sanja Zivanovic, Francesco Colizzi, et al.Proceedings of the National Academy of Sciences of the United States of America|August 20, 2014
Direct measurement of the dielectric polarization properties of DNAAna Cuervo, Pablo D Dans, José L Carrascosa, et al.Pageof 50