The Mediterranean Institute for Life Sciences--an attempt at scientific excellence in Croatia.
Zagrovic Bojan
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
Childhood of a phoenix: modern biology in Eastern and South-Eastern Europe.
Zagrovic Bojan, Dikic Ivan
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
Computational Analysis of the Mechanism and Thermodynamics of Inhibition of Phosphodiesterase 5A by Synthetic Ligands.
Zagrovic Bojan, van Gunsteren Wilfred F
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
How large is an alpha-helix? Studies of the radii of gyration of helical peptides by small-angle X-ray scattering and molecular dynamics.
Zagrovic Bojan, Jayachandran Guha, Millett Ian S, Doniach Sebastian, Pande Vijay S
Unusual compactness of a polyproline type II structure.
Zagrovic Bojan, Lipfert Jan, Sorin Eric J, Millett Ian S, van Gunsteren Wilfred F, Doniach Sebastian, Pande Vijay S
How does averaging affect protein structure comparison on the ensemble level?
Zagrovic Bojan, Pande Vijay S
Random-coil behavior and the dimensions of chemically unfolded proteins.
Kohn Jonathan E, Millett Ian S, Jacob Jaby, Zagrovic Bojan, Dillon Thomas M, Cingel Nikolina, Dothager Robin S, Seifert Soenke, Thiyagarajan P, Sosnick Tobin R, Hasan M Zahid, Pande Vijay S, Ruczinski Ingo, Doniach Sebastian, Plaxco Kevin W
Folding probabilities: a novel approach to folding transitions and the two-dimensional Ising-model.
Lenz Peter, Zagrovic Bojan, Shapiro Jessica, Pande Vijay S
Structural correspondence between the alpha-helix and the random-flight chain resolves how unfolded proteins can have native-like properties.
Zagrovic Bojan, Pande Vijay S
Solvent viscosity dependence of the folding rate of a small protein: distributed computing study.
Zagrovic Bojan, Pande Vijay
Atomistic protein folding simulations on the submillisecond time scale using worldwide distributed computing.
Pande Vijay S, Baker Ian, Chapman Jarrod, Elmer Sidney P, Khaliq Siraj, Larson Stefan M, Rhee Young Min, Shirts Michael R, Snow Christopher D, Sorin Eric J, Zagrovic Bojan
The Trp cage: folding kinetics and unfolded state topology via molecular dynamics simulations.
Snow Christopher D, Zagrovic Bojan, Pande Vijay S
Simulation of folding of a small alpha-helical protein in atomistic detail using worldwide-distributed computing.
Zagrovic Bojan, Snow Christopher D, Shirts Michael R, Pande Vijay S
Native-like mean structure in the unfolded ensemble of small proteins.
Zagrovic Bojan, Snow Christopher D, Khaliq Siraj, Shirts Michael R, Pande Vijay S
Beta-hairpin folding simulations in atomistic detail using an implicit solvent model.
Zagrovic B, Sorin E J, Pande V