Publicaciones

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2015

New Monte Carlo Based Technique To Study DNA–Ligand Interactions

Journal of Chemical Theory and Computation

I. Cabeza de Vaca, M F. Lucas, and V. Guallar
Steroid hydroxylation by basidiomycete peroxygenases: A combined experimental and computational study

Applied and environmental microbiology

E. D. Babot, C. José, M. Cañellas, F. Sancho, F. Lucas, V. Guallar, L. Kalum, H. Lund, G. Gröbe, K. Scheibner, and
Aromatic stacking interactions govern catalysis in aryl-alcohol oxidase

FEBS Journal

P. Ferreira, A. Hernández-Ortega, F. Lucas, J. Carro, B. Herguedas, K. W. Borrelli, V. Guallar, A. T. Martínez, and M. Medina

2014

Structural basis for the recruitment and activation of the Legionella phospholipase VipD by the host GTPase Rab5.

Proc Natl Acad Sci U S A

M. Lucas, A. H. Gaspar, C. Pallara, A. Lucely Rojas, J. Fernandez-Recio, M. P. Machner, and A. Hierro
Atomic Level Rendering of DNA-Drug Encounter

Biophysical Journal

M. F. Lucas, I. Cabeza de Vaca, R. Takahashi, J. Rubio-Martinez, and V. Guallar
Atomic Picture of Ligand Migration in Toluene 4-Monooxygenase

The Journal of Physical Chemistry B

A. Hosseini, M. Brouk, M F. Lucas, F. Glaser, A. Fishman, and V. Guallar

2013

Electron transfer in proteins: theory, applications and future perspectives.

Physical chemistry chemical physics : PCCP

S. Saen-oon, M F. Lucas, and V. Guallar
Single vs. multiple ligand pathways in globins: A computational view.

Biochimica et biophysica acta

F. M. Lucas, and V. Guallar
Formation of a tyrosine adduct involved in lignin degradation by Trametopsis cervina lignin peroxidase: a novel peroxidase activation mechanism.

The Biochemical journal

Y. Miki, R. Pogni, S. Acebes, F. Lucas, E. Fernández-Fueyo, M C. Baratto, M. I. Fernández, V. de Los Ríos, F. J. Ruiz-Dueñas, A. Sinicropi, R. Basosi, K. E. Hammel, V. Guallar, and A. T. Martínez
Comparative analysis of inner cavities and ligand migration in non-symbiotic AHb1 and AHb2.

Biochimica et biophysica acta

F. Spyrakis, F. Lucas, A. Bidon-Chanal, C. Viappiani, V. Guallar, and J. F. Luque

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