Antimicrobial Peptides Induce Growth of Phosphatidylglycerol Domains in a Model Bacterial Membrane
Polyansky A; Ramaswamy R; Volynsky P; Sbalzarini I, Marrink S; Efremov R
Intrinsically disordered regions may lower the hydration free energy in proteins: a case study of nudix hydrolase in the bacterium Deinococcus radiodurans.
Awile, Omar; Krisko, Anita; Sbalzarini, Ivo F; Zagrovic, Bojan
Hydrophilicity matching - a potential prerequisite for the formation of protein-protein complexes in the cell.
Hlevnjak, Mario; Zitkovic, Gordan; Zagrovic, Bojan
Determination of ensemble-average pairwise root mean-square deviation from experimental B-factors.
Kuzmanic, Antonija; Zagrovic, Bojan
Conformational averaging in structural biology: issues, challenges and computational solutions.
Kruschel, Daniela; Zagrovic, Bojan
In the eye of the beholder: Inhomogeneous distribution of high-resolution shapes within the random-walk ensemble.
Müller, Christian L; Sbalzarini, Ivo F; van Gunsteren, Wilfred F; Zagrovi?, Bojan; Hünenberger, Philippe H
Conformational selection and induced fit mechanism underlie specificity in noncovalent interactions with ubiquitin.
Wlodarski, Tomasz; Zagrovic, Bojan
The Mediterranean Institute for Life Sciences--an attempt at scientific excellence in Croatia.
Structure and dynamics of two beta-peptides in solution from molecular dynamics simulations validated against experiment.
Zagrovic, Bojan; Gattin, Zrinka; Lau, Justin Kai-Chi; Huber, Matthias; van Gunsteren, Wilfred F
Computational study of the mechanism and the relative free energies of binding of anticholesteremic inhibitors to squalene-hopene cyclase.
Schwab, Fabienne; van Gunsteren, Wilfred F; Zagrovic, Bojan
Childhood of a phoenix: modern biology in Eastern and South-Eastern Europe.
Zagrovic, Bojan; Dikic, Ivan
Folding-unfoldingequilibrium of a methylidenesubstituted beta-peptide
Schmid N, Zagrovic B, van Gunsteren WF
Helical signature motif in the fiber diffraction patterns of random walk chains
Computational Analysis of the Mechanism and Thermodynamics of Inhibition of Phosphodiesterase 5A by Synthetic Ligands
Bojan Zagrovic; Wilfred F. van Gunsteren
Mechanism and thermodynamics of binding of the polypyrimidine tract binding protein to RNA.
Schmid, Nathan; Zagrovic, Bojan; van Gunsteren, Wilfred F
Simulated unfolded-state ensemble and the experimental NMR structures of villin headpiece yield similar wide-angle solution X-ray scattering profiles.
Zagrovic, Bojan; Pande, Vijay S
Comparing atomistic simulation data with the NMR experiment: how much can NOEs actually tell us?
Zagrovic, Bojan; van Gunsteren, Wilfred F