Peter H. Koenig
Peter H. Koenig
Beauty Modeling and Simulation, Procter and Gamble
Verified email at pg.com
Title
Cited by
Cited by
Year
Development of effective quantum mechanical/molecular mechanical (QM/MM) methods for complex biological processes
D Riccardi, P Schaefer, Y Yang, H Yu, N Ghosh, X Prat-Resina, P König, ...
The Journal of Physical Chemistry B 110 (13), 6458-6469, 2006
3162006
Color tuning in rhodopsins: the mechanism for the spectral shift between bacteriorhodopsin and sensory rhodopsin II
M Hoffmann, M Wanko, P Strodel, PH König, T Frauenheim, K Schulten, ...
Journal of the American Chemical Society 128 (33), 10808-10818, 2006
2082006
A critical evaluation of different QM/MM frontier treatments with SCC-DFTB as the QM method
PH König, M Hoffmann, T Frauenheim, Q Cui
The Journal of Physical Chemistry B 109 (18), 9082-9095, 2005
1582005
“Proton holes” in long-range proton transfer reactions in solution and enzymes: A theoretical analysis
D Riccardi, P König, X Prat-Resina, H Yu, M Elstner, T Frauenheim, Q Cui
Journal of the American Chemical Society 128 (50), 16302-16311, 2006
1312006
Molecular Dynamics Simulations of Sodium Dodecyl Sulfate Micelles in Water The Effect of the Force Field
X Tang, PH Koenig, RG Larson
The Journal of Physical Chemistry B 118 (14), 3864-3880, 2014
1082014
Toward theoretical analyis of long-range proton transfer kinetics in biomolecular pumps
PH König, N Ghosh, M Hoffmann, M Elstner, E Tajkhorshid, T Frauenheim, ...
The Journal of Physical Chemistry A 110 (2), 548-563, 2006
922006
Proton transfer in carbonic anhydrase is controlled by electrostatics rather than the orientation of the acceptor
D Riccardi, P König, H Guo, Q Cui
Biochemistry 47 (8), 2369-2378, 2008
832008
Asymmetric electrostatic and hydrophobic–hydrophilic interaction forces between mica surfaces and silicone polymer thin films
SH Donaldson Jr, S Das, MA Gebbie, M Rapp, LC Jones, Y Roiter, ...
ACS nano 7 (11), 10094-10104, 2013
602013
Self-assembly and bilayer–micelle transition of fatty acids studied by replica-exchange constant pH molecular dynamics
BH Morrow, PH Koenig, JK Shen
Langmuir 29 (48), 14823-14830, 2013
452013
Atomistic simulations of pH-dependent self-assembly of micelle and bilayer from fatty acids
BH Morrow, PH Koenig, JK Shen
The Journal of chemical physics 137 (19), 194902, 2012
392012
Multiscale modeling of the effects of salt and perfume raw materials on the rheological properties of commercial threadlike micellar solutions
X Tang, W Zou, PH Koenig, SD McConaughy, MR Weaver, DM Eike, ...
The Journal of Physical Chemistry B 121 (11), 2468-2485, 2017
342017
Establishing effective simulation protocols for β-and α/β-peptides. II. Molecular Mechanical (MM) model for a cyclic β-residue
X Zhu, P Koenig, SH Gellman, A Yethiraj, Q Cui
The Journal of Physical Chemistry B 112 (17), 5439-5448, 2008
272008
Establishing effective simulation protocols for β‐and α/β‐peptides. III. Molecular mechanical model for acyclic β‐amino acids
X Zhu, P Koenig, M Hoffmann, A Yethiraj, Q Cui
Journal of computational chemistry 31 (10), 2063-2077, 2010
262010
Simulating pH titration of a single surfactant in ionic and nonionic surfactant micelles
BH Morrow, Y Wang, JA Wallace, PH Koenig, JK Shen
The Journal of Physical Chemistry B 115 (50), 14980-14990, 2011
252011
Compositions for treating skin
KS Wei, ED Smith III, SL Mansfield, PH Koenig, W Ji, Y Suradkar, ...
US Patent 9,750,674, 2017
212017
Determination of characteristic lengths and times for wormlike micelle solutions from rheology using a mesoscopic simulation method
W Zou, X Tang, M Weaver, P Koenig, RG Larson
Journal of Rheology 59 (4), 903-934, 2015
212015
Molecular force field parametrization using multi-objective evolutionary algorithms
S Mostaghim, M Hoffmann, PH Konig, T Frauenheim, J Teich
Proceedings of the 2004 Congress on Evolutionary Computation (IEEE Cat. No …, 2004
212004
Compositions comprising hydrophobically modified cationic polymers
Y Gizaw, RJ Harrington, DJ White Jr, F Hulskotter, SD Smith, PH Koenig, ...
US Patent App. 13/945,939, 2014
192014
From well-entangled to partially-entangled wormlike micelles
W Zou, G Tan, H Jiang, K Vogtt, M Weaver, P Koenig, G Beaucage, ...
Soft matter 15 (4), 642-655, 2019
172019
Molecular dynamics simulations of ionic and nonionic surfactant micelles with a generalized born implicit‐solvent model
Y Wang, JA Wallace, PH Koenig, JK Shen
Journal of computational chemistry 32 (11), 2348-2358, 2011
172011
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