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Ion Pathways in the Sarcoplasmic Reticulum Ca2+-ATPase

The Journal of biological chemistry, 2013-04, Vol.288 (15), p.10759-10765

2013

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Bicelles and Other Membrane Mimics: Comparison of Structure, Properties, and Dynamics from MD Simulations

The journal of physical chemistry. B, 2015-12, Vol.119 (52), p.15831-15843

2015

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Protonation States of Important Acidic Residues in the Central Ca2+ Ion Binding Sites of the Ca2+-ATPase: A Molecular Modeling Study

Biochemistry (Easton), 2011-12, Vol.50 (51), p.11109-11120

2011

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Mutual adaptation of a membrane protein and its lipid bilayer during conformational changes

Nature communications, 2011, Vol.2 (1), p.304-304, Article 304

2011

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Peptide Aggregation and Pore Formation in a Lipid Bilayer: A Combined Coarse-Grained and All Atom Molecular Dynamics Study

Biophysical journal, 2008-11, Vol.95 (9), p.4337-4347

2008

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Flexible P-type ATPases interacting with the membrane

Current opinion in structural biology, 2012-08, Vol.22 (4), p.491-499

2012

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Conformational flexibility of the leucine binding protein examined by protein domain coarse-grained molecular dynamics

Journal of molecular modeling, 2013-11, Vol.19 (11), p.4931-4945

2013

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Tracing Cytoplasmic Ca2+ Ion and Water Access Points in the Ca2+-ATPase

Biophysical journal, 2012-01, Vol.102 (2), p.268-277

2012

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Modeling the Self-Assembly and Stability of DHPC Micelles Using Atomic Resolution and Coarse Grained MD Simulations

Journal of chemical theory and computation, 2012-05, Vol.8 (5), p.1556-1569

2012

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The augmented Roothaan-Hall method for optimizing Hartree-Fock and Kohn-Sham density matrices

The Journal of chemical physics, 2008-09, Vol.129 (12), p.124106-124106

2008

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Regulation of the Ca2+-ATPase by cholesterol: A specific or non-specific effect?

Molecular membrane biology, 2015-04, Vol.32 (3), p.75-87

2015

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Lipid Dynamics Studied by Calculation of 31P Solid-State NMR Spectra Using Ensembles from Molecular Dynamics Simulations

The journal of physical chemistry. B, 2014-05, Vol.118 (19), p.5119-5129

2014

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Incorporation of Antimicrobial Peptides into Membranes: A Combined Liquid-State NMR and Molecular Dynamics Study of Alamethicin in DMPC/DHPC Bicelles

The journal of physical chemistry. B, 2009-05, Vol.113 (19), p.6928-6937

2009

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A coupled cluster and full configuration interaction study of CN and CN

Chemical physics letters, 2004-07, Vol.393 (1), p.36-43

2004

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Resolution Enhancement in Solid-State NMR of Oriented Membrane Proteins by Anisotropic Differential Linebroadening

Journal of the American Chemical Society, 2008-04, Vol.130 (15), p.5028-5029

2008

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Linear-scaling implementation of molecular response theory in self-consistent field electronic-structure theory

The Journal of chemical physics, 2007-04, Vol.126 (15), p.154108-154108

2007

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Equilibrium Geometry of the Ethynyl (CCH) Radical

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2004-04, Vol.108 (15), p.3030-3034

2004

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An Elastic Network Coarse Grained MD Model Tested on Protein with Hinge Movement upon Ligand Binding

Biophysical journal, 2012-01, Vol.102 (3), p.736a-736a

2012

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Linear-scaling implementation of molecular electronic self-consistent field theory

The Journal of chemical physics, 2007-03, Vol.126 (11), p.114110-114110

2007

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Tracing cytoplasmic Ca(2+) ion and water access points in the Ca(2+)-ATPase

Biophysical journal, 2012-01, Vol.102 (2), p.268-277

2012

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Protonation States of Important Acidic Residues in the Central Ca 2+ Ion Binding Sites of the Ca 2+ -ATPase: A Molecular Modeling Study

Biochemistry (Easton), 2011-12, Vol.50 (51), p.11109-11120

2011

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Regulation of the Ca(2+)-ATPase by cholesterol: a specific or non-specific effect?

Molecular membrane biology, 2015, Vol.32 (3), p.75-87

2015

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Lipid Dynamics Studied by Calculation of 31 P Solid-State NMR Spectra Using Ensembles from Molecular Dynamics Simulations

The journal of physical chemistry. B, 2014-05, Vol.118 (19), p.5119-5129

2014

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Tracing Cytoplasmic Ca^sup 2+^ Ion and Water Access Points in the Ca^sup 2+^-ATPase

Biophysical journal, 2012-01, Vol.102 (2), p.268

2012

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Regulation of the Ca 2+ -ATPase by cholesterol: A specific or non-specific effect?

Molecular membrane biology, 2015-08, Vol.32 (3), p.75-87

2015

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Ion Pathways in the Sarcoplasmic Reticulum Ca2+-ATPase

Bicelles and Other Membrane Mimics: Comparison of Structure, Properties, and Dynamics from MD Simulations

Protonation States of Important Acidic Residues in the Central Ca2+ Ion Binding Sites of the Ca2+-ATPase: A Molecular Modeling Study

Mutual adaptation of a membrane protein and its lipid bilayer during conformational changes

Peptide Aggregation and Pore Formation in a Lipid Bilayer: A Combined Coarse-Grained and All Atom Molecular Dynamics Study

Flexible P-type ATPases interacting with the membrane

Conformational flexibility of the leucine binding protein examined by protein domain coarse-grained molecular dynamics

Tracing Cytoplasmic Ca2+ Ion and Water Access Points in the Ca2+-ATPase

Modeling the Self-Assembly and Stability of DHPC Micelles Using Atomic Resolution and Coarse Grained MD Simulations

The augmented Roothaan-Hall method for optimizing Hartree-Fock and Kohn-Sham density matrices

Regulation of the Ca2+-ATPase by cholesterol: A specific or non-specific effect?

Lipid Dynamics Studied by Calculation of 31P Solid-State NMR Spectra Using Ensembles from Molecular Dynamics Simulations

Incorporation of Antimicrobial Peptides into Membranes: A Combined Liquid-State NMR and Molecular Dynamics Study of Alamethicin in DMPC/DHPC Bicelles

A coupled cluster and full configuration interaction study of CN and CN

Resolution Enhancement in Solid-State NMR of Oriented Membrane Proteins by Anisotropic Differential Linebroadening

Linear-scaling implementation of molecular response theory in self-consistent field electronic-structure theory

Equilibrium Geometry of the Ethynyl (CCH) Radical

An Elastic Network Coarse Grained MD Model Tested on Protein with Hinge Movement upon Ligand Binding

Linear-scaling implementation of molecular electronic self-consistent field theory

Tracing cytoplasmic Ca(2+) ion and water access points in the Ca(2+)-ATPase

Protonation States of Important Acidic Residues in the Central Ca 2+ Ion Binding Sites of the Ca 2+ -ATPase: A Molecular Modeling Study

Regulation of the Ca(2+)-ATPase by cholesterol: a specific or non-specific effect?

Lipid Dynamics Studied by Calculation of 31 P Solid-State NMR Spectra Using Ensembles from Molecular Dynamics Simulations

Tracing Cytoplasmic Ca^sup 2+^ Ion and Water Access Points in the Ca^sup 2+^-ATPase

Regulation of the Ca 2+ -ATPase by cholesterol: A specific or non-specific effect?

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