| Recent Publications: | | "Relaxation time prediction for a light switchable peptide by molecular dynamics"
Robert Denschlag, Wolfgang J. Schreier, Benjamin Rieff, Tobias E. Schrader, Florian O. Koller, Luis Moroder, Wolfgang Zinth, and Paul Tavan
Phys. Chem. Chem. Phys.12, 6204-6218 (2010) details
"Highly polar environments catalyze the unfolding of
PrPC helix 1"
Martin Lingenheil, Robert Denschlag, and Paul Tavan
Eur. Biophys. J. 39, 1177-1192 (2010). details
"Efficiency of exchange schemes in replica exchange"
Martin Lingenheil, Robert Denschlag, Gerald Mathias, Paul Tavan
Chem. Phys. Lett. 478, 80–84 (2009) details
"Simulated solute tempering"
Robert Denschlag, Martin Lingenheil, Paul Tavan, Gerald Mathias
J. Chem. Theory Comput. 5, 28474-2857 (2009) details
"Polarization effects stabilize bacteriorhodopsin's chromophore binding pocket:
A molecular dynamics study."
Galina Babitzki, Robert Denschlag, Paul Tavan
J. Phys. Chem. B 113, 10483–10495 (2009) details
"Optimal temperature ladders in replica exchange simulations."
Robert Denschlag, Martin Lingenheil, Paul Tavan
Chem. Phys. Lett. 473, 193-195 (2009) details
"Efficiency reduction and pseudo-convergence in replica exchange sampling of peptide folding-unfolding equilibria"
Robert Denschlag, Martin Lingenheil, and Paul Tavan
Chem. Phys. Lett. 458, 244-248 (2008) details
"The "Hot-Solvent/Cold-Solute" Problem Revisited"
Martin Lingenheil, Robert Denschlag, Rudolf Reichold, and Paul Tavan
J. Chem. Theory Comput. 4, 1293-1306 (2008) details
"Light triggered β-hairpin folding and unfolding"
T. E. Schrader, W. J. Schreier, T. Cordes, F. O. Koller, G. Babitzki, R. Denschlag, C. Renner, S.-L. Dong, M. Löweneck, L. Moroder, P. Tavan, and W. Zinth
Proc. Natl. Acad. Sci. USA 104 (2007) 15729-15734. details
"Ultrafast Unzipping of a Beta-Hairpin Peptide"
W. Zinth, T. E. Schrader, W. J. Schreier, F. O. Koller, T. Cordes, G. Babitzki, R. Denschlag, P. Tavan, M. Loeweneck, S.-L. Dong, L. Moroder, C. Renner
Ultrafast Phenomena XV, P. Corkum, D. Jonas, R. J. D. Miller, A. M. Weiner, Springer Series in Chemical Physics 88 (2007) 498-500 details
alle 11 Publikationen |
