Transient conformations in the unliganded FK506 binding domain of FKBP51 correspond to two distinct inhibitor-bound states von Anderson, Janet S., LeMaster, David M., Hernández, Griselda

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Molecular Dynamics-Assisted Optimization of Protein NMR Relaxation Analysis von Anderson, Janet S, Hernández, Griselda, LeMaster, David M

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13 C NMR Relaxation Analysis of Protein GB3 for the Assessment of Side Chain Dynamics Predictions by Current AMBER and CHARMM Force Fields von Anderson, Janet S, Hernández, Griselda, LeMaster, David M

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Electrostatic Stabilization and General Base Catalysis in the Active Site of the Human Protein Disulfide Isomerase a Domain Monitored by Hydrogen Exchange von Hernández, Griselda, Anderson, Janet S, LeMaster, David M

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Prediction of Bond Vector Autocorrelation Functions from Larmor Frequency-Selective Order Parameter Analysis of NMR Relaxation Data von Anderson, Janet S, Hernández, Griselda, LeMaster, David M

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Rotational velocity rescaling of molecular dynamics trajectories for direct prediction of protein NMR relaxation von Anderson, Janet S., LeMaster, David M.

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Polarization and Polarizability Assessed by Protein Amide Acidity von Hernández, Griselda, Anderson, Janet S, LeMaster, David M

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Assessing the chemical accuracy of protein structures via peptide acidity von Anderson, Janet S., Hernández, Griselda, LeMaster, David M.

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Experimentally assessing molecular dynamics sampling of the protein native state conformational distribution von Hernández, Griselda, Anderson, Janet S., LeMaster, David M.

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A Billion-fold Range in Acidity for the Solvent-Exposed Amides of Pyrococcus furiosus Rubredoxin von Anderson, Janet S, Hernández, Griselda, LeMaster, David M

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Statistical allosteric coupling to the active site indole ring flip equilibria in the FK506-binding domain von Anderson, Janet S., Mustafi, Sourajit M., Hernández, Griselda, LeMaster, David M.

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Peptide Conformer Acidity Analysis of Protein Flexibility Monitored by Hydrogen Exchange von LeMaster, David M, Anderson, Janet S, Hernández, Griselda

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Assessing the native state conformational distribution of ubiquitin by peptide acidity von Hernández, Griselda, Anderson, Janet S., LeMaster, David M.

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Backbone conformational dependence of peptide acidity von Anderson, Janet S., Hernández, Griselda, LeMaster, David M.

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Sidechain conformational dependence of hydrogen exchange in model peptides von Anderson, Janet S., Hernández, Griselda, LeMaster, David M.

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Role of Native-State Structure in Rubredoxin Native-State Hydrogen Exchange von LeMaster, David M, Anderson, Janet S, Hernández, Griselda

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Electrostatic Potential Energy within a Protein Monitored by Metal Charge-Dependent Hydrogen Exchange von Anderson, Janet S., LeMaster, David M., Hernández, Griselda

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Spatial distribution of dielectric shielding in the interior of Pyrococcus furiosus rubredoxin as sampled in the subnanosecond timeframe by hydrogen exchange von LeMaster, David M., Anderson, Janet S., Hernández, Griselda

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C-13 NMR Relaxation Analysis of Protein GB3 for the Assessment of Side Chain Dynamics Predictions by Current AMBER and CHARMM Force Fields von Anderson, Janet S., Hernandez, Griselda, LeMaster, David M.

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Tetrathiolate coordination of germanium(IV) in a protein active site von LeMaster, David M., Minnich, Michael, Parsons, Patrick J., Anderson, Janet S., Hernández, Griselda

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