1. Research
  2. Molecular Modelling and Bioinformatics
  3. Molecular Modelling and Bioinformatics publications

Molecular Modelling and Bioinformatics publications

Regioselectivity of the OH Radical Addition to Uracil in Nucleic Acids. A Theoretical Approach Based on QM/MM Simulations
Aranda J, Francés-Monerris A, Tuñón I and Roca-Sanjuán D.
J Chem Theory Comput, 13 (10), 5089-5096 (2017)
Inhibition of Human Enhancer of Zeste Homolog 2 with Tambjamine Analogs
Kotev M, Manuel-Manresa P, Hernando E, Soto-Cerrato V, Orozco M, Quesada R, Pérez-Tomás R and Guallar V.
J Chem Inf Model (2017)
Inhibition of Human Enhancer of Zeste Homolog 2 with Tambjamine Analogs
Kotev M, Manuel-Manresa P, Hernando E, Soto-Cerrato V, Orozco M, Quesada R, Pérez-Tomás R and Guallar V.
J Chem Inf Model (2017)
Repair of UV-Induced DNA Damage Independent of Nucleotide Excision Repair Is Masked by MUTYH
Mazouzi A, Battistini F, Moser SC, Ferreira da Silva J, Wiedner M, Owusu M, Lardeau CH, Ringler A, Weil B, Neesen J, Orozco M, Kubicek S and Loizou JI.
Mol Cell, 68 (4), 797-807.e7 (2017)
Prevalent Sequences in the Human Genome Can Form Mini i-Motif Structures at Physiological pH
Mir B, Serrano I, Buitrago D, Orozco M, Escaja N and González C.
J Am Chem Soc, 139 (40), 13985-1398 (2017)
A DNA methylation map of human cancer at single base-pair resolution
Vidal E, Sayols S, Moran S, Guillaumet-Adkins A, Schroeder MP, Royo R, Orozco M, Gut M, Gut I, Lopez-Bigas N, Heyn H and Esteller M.
Oncogene, 36 (40), 5648-5657 (2017)
Structural basis of a histidine-DNA nicking/joining mechanism for gene transfer and promiscuous spread of antibiotic resistance
Pluta R, Boer DR, Lorenzo-Díaz F, Russi S, Gómez H, Fernández-López C, Pérez-Luque R, Orozco M, Espinosa M and Coll M.
P Natl Acad Sci Usa, 114 (32), E6526-E653 (2017)
A DNA methylation map of human cancer at single base-pair resolution
Vidal E, Sayols S, Moran S, Guillaumet-Adkins A, Schroeder MP, Royo R, Orozco M, Gut M, Gut I, Lopez-Bigas N, Heyn H and Esteller M.
Oncogene (2017)
Compaction of Duplex Nucleic Acids upon Native Electrospray Mass Spectrometry
Porrini M, Rosu F, Rabin C, Darré L, Gómez H, Orozco M and Gabelica V.
ACS Comb Sci, 3 (5), 454-461 (2017)
PMut: a web-based tool for the annotation of pathological variants on proteins, 2017 update
López-Ferrando V, Gazzo A, de la Cruz X, Orozco M and Gelpí JL.
Nucleic Acids Res, 45 (W1), W222-W228 (2017)

* shared senior authorship