agrossfield's ion-solvation [23 articles] Export

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	Effect of Headgroup Size, Charge, and Solvent Structure on Polymer−Micelle Interactions, Studied by Molecular Dynamics Simulations [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 46. (19 November 2009), pp. 15170-15180. by Barry Z. Shang, Zuowei Wang, Ronald G. Larson posted to micelles ion-solvation detergent by agrossfield on 2009-11-17 02:34:51 as
	Electrostatic correlations at the Stern layer: Physics or chemistry? [My Copy] The Journal of Chemical Physics, Vol. 131, No. 18. (2009), 185102. by A. Travesset, S. Vangaveti posted to membrane-electrostatics ion-solvation by agrossfield on 2009-11-17 02:31:06 as
	Molecular dynamics simulations of the dynamic and energetic properties of alkali and halide ions using water-model-specific ion parameters. [My Copy] The journal of physical chemistry. B, Vol. 113, No. 40. (8 October 2009), pp. 13279-13290. by In Suk S. Joung, Thomas E. Cheatham posted to ion-solvation by agrossfield on 2009-10-01 18:54:15 as along with 1 person qshao
	Transition path sampling of water exchange rates and mechanisms around aqueous ions [My Copy] The Journal of Chemical Physics, Vol. 131, No. 11. (2009), 114512. by Sebastien Kerisit, Kevin M. Rosso posted to ion-solvation by agrossfield on 2009-09-22 16:35:34 as along with 1 person dlimmer
	Cation specific binding with protein surface charges [My Copy] Proceedings of the National Academy of Sciences of the United States of America, Vol. 106, No. 32. (2009), pp. 13296-13300. by Berk Hess, Nico F. A. van der Vegt posted to ion-solvation by agrossfield on 2009-09-21 17:43:33 as
	On the fluctuations that drive small ions toward, and away from, interfaces between polar liquids and their vapors [My Copy] Proceedings of the National Academy of Sciences, Vol. 106, No. 36. (8 September 2009), pp. 15125-15130. by Joyce Noah-Vanhoucke, Phillip L. Geissler posted to ions ion-solvation by agrossfield on 2009-09-09 18:38:59 as
	Water Modeled As an Intermediate Element between Carbon and Silicon† [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 13. (2 April 2009), pp. 4008-4016. by Valeria Molinero, Emily B. Moore posted to coarse-grain ion-solvation by agrossfield on 2009-07-21 20:44:59 as
	Coarse-grained ions without charges: Reproducing the solvation structure of NaCl in water using short-ranged potentials [My Copy] The Journal of Chemical Physics, Vol. 131, No. 3. (2009), 034107. by Robert C. Demille, Valeria Molinero posted to coarse-grain ion-solvation by agrossfield on 2009-07-21 20:42:34 as along with 1 person dlimmer
	Hydration Number, Topological Control, and Ion Selectivity [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 25. (25 June 2009), pp. 8725-8730. by Haibo Yu, Sergei Y. Noskov, Benoît Roux posted to ion-channel ion-solvation by agrossfield on 2009-06-19 15:35:18 as
	Restoring Charge Asymmetry in Continuum Electrostatics Calculations of Hydration Free Energies [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 24. (18 June 2009), pp. 8206-8209. by Enrico O. Purisima, Traian Sulea posted to ion-solvation by agrossfield on 2009-06-12 19:45:25 as along with 3 people and 1 group Elena_Zubova onufriev sobolevnrm baker-group
	Statistical Determinants of Selective Ionic Complexation: Ions in Solvent, Transport Proteins, and Other Hosts [My Copy] Vol. 96, No. 11. (3 June 2009), pp. 4470-4492. by David L. Bostick, Charles L. Brooks posted to ion-solvation by agrossfield on 2009-06-03 13:39:15 as
	Molecular Renormalization Group Coarse-Graining of Electrolyte Solutions: Application to Aqueous NaCl and KCl [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 22. (4 June 2009), pp. 7785-7793. by Alexey Savelyev, Garegin A. Papoian posted to coarse-grain ion-solvation by agrossfield on 2009-05-29 19:25:59 as along with 2 people and 1 group tomweingarten sobolevnrm baker-group
	Thermodynamically dominant hydration structures of aqueous ions [My Copy] The Journal of Chemical Physics, Vol. 130, No. 19. (2009), 195102. by Safir Merchant, D. Asthagiri posted to ion-solvation by agrossfield on 2009-05-22 12:24:42 as along with 5 people and 1 group afenley mikaellund flbarroso dlimmer sobolevnrm baker-group
	The role of lipid composition for insertion and stabilization of amino acids in membranes [My Copy] The Journal of Chemical Physics, Vol. 130, No. 18. (2009), 185101. by Anna C. V. Johansson, Erik Lindahl posted to ion-solvation membrane-electrostatics membrane-forcefield by agrossfield on 2009-05-15 13:44:37 as along with 2 people and 1 group sobolevnrm paulschlesinger baker-group
	Polarizable Ions at Interfaces [My Copy] Physical Review Letters, Vol. 102, No. 14. (2009), 147803. by Yan Levin posted to ion-solvation polarizability by agrossfield on 2009-05-08 19:21:07 as along with 1 person and 1 group sobolevnrm baker-group
	On the origin of the electrostatic potential difference at a liquid-vacuum interface [My Copy] The Journal of Chemical Physics, Vol. 129, No. 23. (2008) by Edward Harder, Benoît Roux posted to ion-solvation by agrossfield on 2008-12-19 20:33:42 as along with 1 person and 1 group sobolevnrm baker-group
	The solvation of NaCl in model water with different hydrogen bond strength [My Copy] The Journal of Chemical Physics, Vol. 129, No. 18. (2008) by B. Gu, F. S. Zhang, Z. P. Wang, H. Y. Zhou posted to ion-solvation by agrossfield on 2008-12-04 21:47:05 as
	Single ion hydration free energies: A consistent comparison between experiment and classical molecular simulation [My Copy] The Journal of Chemical Physics, Vol. 129, No. 20. (2008) by Henry S. Ashbaugh, D. Asthagiri posted to ion-solvation by agrossfield on 2008-11-26 17:46:02 as along with 1 person and 1 group sobolevnrm baker-group
	Electrostatic Properties of Aqueous Salt Solution Interfaces: A Comparison of Polarizable and Nonpolarizable Ion Models [My Copy] Journal of Physical Chemistry B, Vol. 112, No. 37. (2008), pp. 11679-11693. by G. L. Warren, S. Patel posted to forcefield ion-solvation by agrossfield on 2008-09-13 17:39:51 as
	Specific Ion Binding to Nonpolar Surface Patches of Proteins [My Copy] J. Am. Chem. Soc. (8 August 2008) by Mikael Lund, Luboš Vrbka, Pavel Jungwirth posted to ion-solvation by agrossfield on 2008-08-27 17:57:14 as along with 2 people mikaellund paulschlesinger
	Not Only Enthalpy: Large Entropy Contribution to Ion Permeation Barriers in Single-File Channels [My Copy] Biophys. J., Vol. 95, No. 5. (1 September 2008), pp. 2275-2282. by Guillem Portella, Jochen S. Hub, Martin D. Vesper, Bert L. de Groot posted to ion-channel ion-solvation by agrossfield on 2008-08-15 21:17:14 as along with 1 person paulschlesinger
	Determination of Alkali and Halide Monovalent Ion Parameters for Use in Explicitly Solvated Biomolecular Simulations [My Copy] Journal of Physical Chemistry B, Vol. 112, No. 30. (2008), pp. 9020-9041. by In S. Joung, Thomas posted to ion-solvation by agrossfield on 2008-07-24 13:29:39 as
	Simulation of Ca2+ and Mg2+ Solvation Using Polarizable Atomic Multipole Potential [My Copy] J. Phys. Chem. B, Vol. 110, No. 37. (21 September 2006), pp. 18553-18559. by D. Jiao, C. King, A. Grossfield, T. A. Darden, P. Ren posted to me pengyu ion-solvation by agrossfield on 2008-04-05 18:43:49 as

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antimicrobial-peptide	83
coarse-grain	54
free-energy	30
membrane	24
ion-solvation	23
nmr	20
lipid-protein-interactions	20
gpcr	19
membrane-proteins	19
membrane-electrostatics	18
rhodopsin	17
implicit-membrane	16
pca	15
replica-exchange	12
lipopeptide	12
rafts	11
network-model	10
implicit-solvent	9
membrane-forcefield	9
protein-folding	8
forcefield	7
internal-water	6
pmf	6
jarzynski	6
ion-channel	6
ligand-binding	5
b2ar	5
electrostatics	5
lipid-curvature	4
scattering	4
me	4
pepducin	4
wham	4
waxs	4
solvation	3
phosphorus	3
amyloid	3
langevin	3
defensin	3
membrane-theory	3
enhanced-sampling	3
integrator	3
thermostats	3
alamethicin	3
membrane-fusion	3
water	2
grand_canonical_ensemble	2
detergent	2
beta-adrenergic	2
isotropic-periodic-sum	2
magainin	2
cholesterol	2
protein-hydration	2
md	2
convergence	2
pores	2
protegrin	2
peptide	2
path-sampling	2
error-analysis	2
dpd	2
bacteriorhodopsin	2
glycophorin	2
multiscale	2
salt	2
lattice	2
polarizability	2
steered-md	1
flip-flop	1
allostery	1
modeling-software	1
lambda-dynamics	1
cecropin	1
unsaturated	1
helfrich	1
hydration	1
superposition	1
pore_size	1
pengyu	1
src	1
pore_formation	1
hiv_virus	1
charge	1
virus	1
dipole-lattice	1
porin	1
vesicles	1
field-theory	1
nmr_spectroscopy	1
micelles	1
demixing	1
hemagglutinin	1
finite-size-effect	1
loop-modeling	1
barrel-stave	1
monte_carlo_method	1
polyunsaturated_fatty_acids	1
ras	1
dendrite	1
colicin	1
fission	1
lipid_bilayer	1
error_distribution	1
drug-development	1
fluoresence	1
umbrella-sampling	1
flu	1
dye	1
dimers	1
ewald	1
markov	1
generalized-born	1
bicelles	1
voltage_sensors	1
nuclear_magnetic_resonance	1
pressure-profile	1
hydrophobic-mismatch	1
structure	1
polymer	1
lipid_membrane	1
neutron_diffraction	1
fabp	1
molecular_dynamics_simulations	1
walp	1
multiple-time-step	1
antibiotic-resistance	1
osmolytes	1
normal-modes	1
gay-berne	1
cryomicroscopy	1
inherent-structure	1
prediction	1
structure-prediction	1
shaw	1
hydrophobicity-scale	1
fluorination	1
nanotube	1
simulation	1
methods	1
rigid-body	1
hiv	1
ions	1
clustering	1
g_protein_coupled_receptor	1
sevi	1
potassium_channel	1
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agrossfield's ion-solvation [23 articles] Export

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