Publications

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Carrillo, O., Laughton, C.A. & Orozco, M. Fast Atomistic Molecular Dynamics Simulations from Essential Dynamics Samplings. J. Chem. Theory Comput. (2012).
Talavera, D., Morreale, A., Hospital, A., Ferrer-Costa, C., Gelpí, J.L., de la Cruz, X., Meyer, T., Soliva, R., Luque, F.J. & Orozco, M. A fast method for the determination of fractional contributions to solvation in proteins. (2006).at <http://www.ncbi.nlm.nih.gov/entrez/query.fcgi?db=pubmed&cmd=Retrieve&dopt=AbstractPlus&list_uids=17001031&query_hl=9&itool=pubmed_DocSum>
Sfriso, P., Emperador, A., Orellana, L., Hospital, A., Gelpí, J.L. & Orozco, M. Finding Conformational Transition Pathways from Discrete Molecular Dynamics Simulations. Journal of Chemical Theory and Computation 8, 4707-4718 (2012).
Camps, J., Carrillo, O., Emperador, A., Orellana, L., Hospital, A., Rueda, M., Cicin, D., D'Abramo, M., Gelpí, J.L. & Orozco, M. FlexServ: An integrated tool for the analysis of protein flexibility. (2009).at <http://bioinformatics.oxfordjournals.org/content/25/13/1709.abstract>
Pérez, A., Luque, F.J. & Orozco, M. Frontiers in Molecular Dynamics Simulations of DNA. Accounts of chemical research (2012).doi:10.1021/ar2001217
Terrazas, M., Alagia, A., Faustino, I., Orozco, M. & Eritja, R. Functionalization of the 3'-ends of DNA and RNA strands with N-ethyl-N-coupled nucleosides: a promising approach to avoid 3'-exonuclease-catalyzed hydrolysis of therapeutic oligonucleotides. Chembiochem : a European journal of chemical biology 14, 510-20 (2013).