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Alex Sodt
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The molecular structure of the liquid-ordered phase of lipid bilayers
AJ Sodt, ML Sandar, K Gawrisch, RW Pastor, E Lyman
Journal of the American Chemical Society 136 (2), 725-732, 2014
2452014
Auxiliary basis expansions for large-scale electronic structure calculations
Y Jung, A Sodt, PMW Gill, M Head-Gordon
Proceedings of the National Academy of Sciences 102 (19), 6692-6697, 2005
2412005
CHARMM all-atom additive force field for sphingomyelin: elucidation of hydrogen bonding and of positive curvature
RM Venable, AJ Sodt, B Rogaski, H Rui, E Hatcher, AD MacKerell, ...
Biophysical journal 107 (1), 134-145, 2014
2132014
Linear scaling density fitting
A Sodt, JE Subotnik, M Head-Gordon
The Journal of chemical physics 125 (19), 2006
1682006
A near linear-scaling smooth local coupled cluster algorithm for electronic structure
JE Subotnik, A Sodt, M Head-Gordon
The Journal of chemical physics 125 (7), 2006
1682006
Hexagonal substructure and hydrogen bonding in liquid-ordered phases containing palmitoyl sphingomyelin
AJ Sodt, RW Pastor, E Lyman
Biophysical journal 109 (5), 948-955, 2015
1312015
Predicting accurate electronic excitation transfer rates via Marcus theory with Boys or Edmiston− Ruedenberg localized diabatization
JE Subotnik, J Vura-Weis, AJ Sodt, MA Ratner
The Journal of Physical Chemistry A 114 (33), 8665-8675, 2010
1062010
Depth of α-synuclein in a bilayer determined by fluorescence, neutron reflectometry, and computation
CM Pfefferkorn, F Heinrich, AJ Sodt, AS Maltsev, RW Pastor, JC Lee
Biophysical journal 102 (3), 613-621, 2012
1032012
Hartree-Fock exchange computed using the atomic resolution of the identity approximation
A Sodt, M Head-Gordon
The Journal of chemical physics 128 (10), 2008
872008
Nonadditive compositional curvature energetics of lipid bilayers
AJ Sodt, RM Venable, E Lyman, RW Pastor
Physical review letters 117 (13), 138104, 2016
822016
The limits of local correlation theory: Electronic delocalization and chemically smooth potential energy surfaces
JE Subotnik, A Sodt, M Head-Gordon
The Journal of chemical physics 128 (3), 2008
792008
Bending free energy from simulation: correspondence of planar and inverse hexagonal lipid phases
AJ Sodt, RW Pastor
Biophysical journal 104 (10), 2202-2211, 2013
782013
Molecular modeling of lipid membrane curvature induction by a peptide: more than simply shape
AJ Sodt, RW Pastor
Biophysical journal 106 (9), 1958-1969, 2014
752014
Palmitoylation contributes to membrane curvature in influenza A virus assembly and hemagglutinin-mediated membrane fusion
P Chlanda, E Mekhedov, H Waters, A Sodt, C Schwartz, V Nair, PS Blank, ...
Journal of virology 91 (21), 10.1128/jvi. 00947-17, 2017
662017
Gramicidin A channel formation induces local lipid redistribution I: experiment and simulation
AH Beaven, AM Maer, AJ Sodt, H Rui, RW Pastor, OS Andersen, W Im
Biophysical Journal 112 (6), 1185-1197, 2017
602017
Unrestricted perfect pairing: The simplest wave-function-based model chemistry beyond mean field
GJO Beran, B Austin, A Sodt, M Head-Gordon
The Journal of Physical Chemistry A 109 (40), 9183-9192, 2005
552005
An implicit solvent coarse-grained lipid model with correct stress profile
AJ Sodt, T Head-Gordon
The Journal of chemical physics 132 (20), 2010
512010
The curvature induction of surface-bound antimicrobial peptides piscidin 1 and piscidin 3 varies with lipid chain length
BS Perrin, AJ Sodt, ML Cotten, RW Pastor
Biophysical Journal 108 (2), 498a, 2015
472015
Cholesterol-dependent bending energy is important in cholesterol distribution of the plasma membrane
DW Allender, AJ Sodt, M Schick
Biophysical journal 116 (12), 2356-2366, 2019
402019
Localized orbital theory and ammonia triborane
JE Subotnik, A Sodt, M Head-Gordon
Physical Chemistry Chemical Physics 9 (41), 5522-5530, 2007
392007
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Articles 1–20