Publications

@article{MM.devereux.jpcb:2009,

title = {Anharmonic Coupling in Molecular Dynamics Simulations of Ligand Vibrational Relaxation in Bound Carbonmonoxy Myoglobin},

author = {M. Devereux and M. Meuwly},

year  = {2009},

date = {2009-01-01},

journal = {J. Phys. Chem. B},

volume = {39},

pages = {13061-13070},

keywords = {Anharmonic Coupling, CO Myoglobin, Ligand, Molecular Dynamics Simulations, vibrational relaxation},

pubstate = {published},

tppubtype = {article}

}

@article{MM.devereux.jpca:2009,

title = {Application of Multipolar Charge Models and Molecular Dynamics Simulations to Study Stark Shifts in Inhomogeneous Electric Fields},

author = {M. Devereux and N. Plattner and M. Meuwly},

year  = {2009},

date = {2009-01-01},

journal = {J. Phys. Chem. A},

volume = {113},

pages = {13199},

keywords = {Inhomogeneous Electric Fields, Molecular Dynamics Simulations, Multipolar Charge Models, Stark Shifts},

pubstate = {published},

tppubtype = {article}

}

@article{MM.mishra.bj:2009,

title = {Nitric Oxide Dynamics in Truncated Hemoglobin: Docking Sites, Migration Pathways, and Vibrational Spectroscopy from Molecular Dynamics Simulations},

author = {S. Mishra and M. Meuwly},

year  = {2009},

date = {2009-01-01},

journal = {Biophys. J.},

volume = {96},

pages = {2105},

keywords = {Migration Pathways, Molecular Dynamics Simulations, Nitric Oxide, truncated Hemoglobin, Vibrational Spectroscopy},

pubstate = {published},

tppubtype = {article}

}

@article{MM.plattner.jmm:2009,

title = {Higher Order Multipole Moments for Molecular Dynamics Simulations},

author = {N. Plattner and M. Meuwly},

year  = {2009},

date = {2009-01-01},

journal = {J. Mol. Model.},

volume = {15},

pages = {687},

keywords = {Molecular Dynamics Simulations, Multipole Moments},

pubstate = {published},

tppubtype = {article}

}