Parmbsc1: a refined force field for DNA simulations I Ivani, PD Dans, A Noy, A Pérez, I Faustino, J Walther, P Andrio, R Goñi, ... Nature methods 13 (1), 55, 2016 | 924* | 2016 |
μABC: a systematic microsecond molecular dynamics study of tetranucleotide sequence effects in B-DNA M Pasi, JH Maddocks, D Beveridge, TC Bishop, DA Case, T Cheatham III, ... Nucleic acids research 42 (19), 12272-12283, 2014 | 217 | 2014 |
Direct measurement of the dielectric polarization properties of DNA A Cuervo, PD Dans, JL Carrascosa, M Orozco, G Gomila, L Fumagalli Proceedings of the National Academy of Sciences 111 (35), E3624-E3630, 2014 | 205 | 2014 |
Multiscale simulation of DNA PD Dans, J Walther, H Gómez, M Orozco Current opinion in structural biology 37, 29-45, 2016 | 164 | 2016 |
A coarse grained model for atomic-detailed DNA simulations with explicit electrostatics PD Dans, A Zeida, MR Machado, S Pantano Journal of chemical theory and computation 6 (5), 1711-1725, 2010 | 159 | 2010 |
The structural impact of DNA mismatches G Rossetti, PD Dans, I Gomez-Pinto, I Ivani, C Gonzalez, M Orozco Nucleic acids research 43 (8), 4309-4321, 2015 | 152 | 2015 |
Connecting proline and γ-aminobutyric acid in stressed plants through non-enzymatic reactions S Signorelli, PD Dans, EL Coitiño, O Borsani, J Monza PLoS One 10 (3), e0115349, 2015 | 147 | 2015 |
Another coarse grain model for aqueous solvation: WAT FOUR? L Darré, MR Machado, PD Dans, FE Herrera, S Pantano Journal of Chemical Theory and Computation 6 (12), 3793-3807, 2010 | 147 | 2010 |
How accurate are accurate force-fields for B-DNA? PD Dans, I Ivani, A Hospital, G Portella, C González, M Orozco Nucleic Acids Research 45 (7), 4217-4230, 2017 | 138* | 2017 |
Epigenetic loss of RNA-methyltransferase NSUN5 in glioma targets ribosomes to drive a stress adaptive translational program M Janin, V Ortiz-Barahona, MC de Moura, A Martínez-Cardús, ... Acta Neuropathologica, 1-22, 2019 | 130 | 2019 |
Long-timescale dynamics of the Drew–Dickerson dodecamer PD Dans, L Danilāne, I Ivani, T Dršata, F Lankaš, A Hospital, J Walther, ... Nucleic Acids Research 44 (9), 4052-4066, 2016 | 125* | 2016 |
Glyceraldehyde-3-phosphate dehydrogenase is a chaperone that allocates labile heme in cells EA Sweeny, AB Singh, R Chakravarti, O Martinez-Guzman, A Saini, ... Journal of Biological Chemistry 293 (37), 14557-14568, 2018 | 102 | 2018 |
Exploring polymorphisms in B-DNA helical conformations PD Dans, A Perez, I Faustino, R Lavery, M Orozco Nucleic acids research 40 (21), 10668-10678, 2012 | 96 | 2012 |
Unraveling the sequence-dependent polymorphic behavior of d (CpG) steps in B-DNA PD Dans, I Faustino, F Battistini, K Zakrzewska, R Lavery, M Orozco Nucleic acids research 42 (18), 11304-11320, 2014 | 87 | 2014 |
Switching reversibility to irreversibility in glycogen synthase kinase 3 inhibitors: clues for specific design of new compounds DI Perez, V Palomo, C Pérez, C Gil, PD Dans, FJ Luque, S Conde, ... Journal of Medicinal Chemistry 54 (12), 4042-4056, 2011 | 85 | 2011 |
Impact of DNA methylation on 3D genome structure D Buitrago, M Labrador, JP Arcon, R Lema, O Flores, A Esteve-Codina, ... Nature Communication 12, 3243, 2021 | 76 | 2021 |
A hybrid all-atom/coarse grain model for multiscale simulations of DNA MR Machado, PD Dans, S Pantano Physical Chemistry Chemical Physics 13 (40), 18134-18144, 2011 | 57 | 2011 |
Saturation of recognition elements blocks evolution of new tRNA identities A Saint-Léger, C Bello, PD Dans, AG Torres, EM Novoa, N Camacho, ... Science advances 2 (4), e1501860, 2016 | 56 | 2016 |
BIGNASim: a NoSQL database structure and analysis portal for nucleic acids simulation data A Hospital, P Andrio, C Cugnasco, L Codo, Y Becerra, PD Dans, ... Nucleic acids research 44 (D1), D272-D278, 2016 | 51 | 2016 |
Breathing, bubbling, and bending: DNA flexibility from multimicrosecond simulations A Zeida, MR Machado, PD Dans, S Pantano Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 86 (2 …, 2012 | 49 | 2012 |