Published in J Chem Phys on January 28, 2010
Snapshot of the equilibrium dynamics of a drug bound to HIV-1 reverse transcriptase. Nat Chem (2013) 1.24
2D IR photon echo of azido-probes for biomolecular dynamics. Phys Chem Chem Phys (2010) 1.15
Identification of arginine residues in peptides by 2D-IR echo spectroscopy. J Phys Chem A (2011) 0.99
Two-dimensional infrared spectral signature and hydration of the oxalate dianion. J Chem Phys (2011) 0.92
A peptide's perspective of water dynamics. Chem Phys (2011) 0.89
Differential hydration of tricyanomethanide observed by time resolved vibrational spectroscopy. J Phys Chem B (2012) 0.85
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Hydration and vibrational dynamics of betaine (N,N,N-trimethylglycine). J Chem Phys (2015) 0.79
Two-Dimensional Infrared Study of Vibrational Coupling between Azide and Nitrile Reporters in a RNA Nucleoside. J Phys Chem B (2016) 0.77
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Scalable molecular dynamics with NAMD. J Comput Chem (2005) 59.49
Two-dimensional infrared spectroscopy of the alanine dipeptide in aqueous solution. J Phys Chem B (2005) 2.52
Ultrafast vibrational spectroscopy of water and aqueous N-methylacetamide: Comparison of different electronic structure/molecular dynamics approaches. J Chem Phys (2004) 1.76
Frequency-frequency correlation functions and apodization in two-dimensional infrared vibrational echo spectroscopy: a new approach. J Chem Phys (2007) 1.54
Electrostatic DFT map for the complete vibrational amide band of NMA. J Phys Chem A (2005) 1.43
Taking apart the two-dimensional infrared vibrational echo spectra: more information and elimination of distortions. J Chem Phys (2008) 1.42
Nitrile and thiocyanate IR probes: quantum chemistry calculation studies and multivariate least-square fitting analysis. J Chem Phys (2008) 1.41
Vibrational relaxation dynamics in solutions. Annu Rev Phys Chem (1994) 1.39
IR and Raman spectra of liquid water: theory and interpretation. J Chem Phys (2008) 1.37
Hydrogen bonding definitions and dynamics in liquid water. J Chem Phys (2007) 1.36
Why water reorientation slows without iceberg formation around hydrophobic solutes. J Phys Chem B (2009) 1.33
Analogous inhibitors of elastase do not always bind analogously. Nat Struct Biol (1994) 1.22
2D-IR experiments and simulations of the coupling between amide-I and ionizable side chains in proteins: application to the Villin headpiece. J Phys Chem B (2009) 1.17
Observation of immobilized water molecules around hydrophobic groups. Phys Rev Lett (2007) 1.15
Ultrafast vibrational spectroscopy of a degenerate mode of guanidinium chloride. J Phys Chem B (2009) 1.10
Correlation of the vibrations of the aqueous azide ion with the O-H modes of bound water molecules. J Phys Chem B (2007) 1.02
Easy interpretation of optical two-dimensional correlation spectra. Opt Lett (2006) 0.97
Probing intermolecular couplings in liquid water with two-dimensional infrared photon echo spectroscopy. J Chem Phys (2008) 0.96
Vibrational energy relaxation of azide in water. J Chem Phys (2006) 0.86
Vibrational dynamics of carboxylic acid dimers in gas and dilute solution. Phys Chem Chem Phys (2007) 0.82
Impact of anisotropy on the structure and dynamics of ionic liquids: a computational study of 1-butyl-3-methyl-imidazolium trifluoroacetate. J Chem Phys (2007) 0.81
Hydration of carboxylate anions: infrared spectroscopy of aqueous solutions. J Phys Chem B (2009) 0.80
Wide-field subdiffraction imaging by accumulated binding of diffusing probes. Proc Natl Acad Sci U S A (2006) 4.33
Two-dimensional infrared spectroscopy of the alanine dipeptide in aqueous solution. J Phys Chem B (2005) 2.52
Oxygen microscopy by two-photon-excited phosphorescence. Chemphyschem (2008) 2.17
Chemical exchange 2D IR of hydrogen-bond making and breaking. Proc Natl Acad Sci U S A (2005) 2.09
Two-dimensional infrared spectra of isotopically diluted amyloid fibrils from Abeta40. Proc Natl Acad Sci U S A (2008) 1.63
Two-dimensional infrared spectra reveal relaxation of the nonnucleoside inhibitor TMC278 complexed with HIV-1 reverse transcriptase. Proc Natl Acad Sci U S A (2007) 1.61
Applications of 2D IR spectroscopy to peptides, proteins, and hydrogen-bond dynamics. J Phys Chem B (2009) 1.54
Phosphorescent oxygen sensor with dendritic protection and two-photon absorbing antenna. J Am Chem Soc (2005) 1.49
2D IR provides evidence for mobile water molecules in beta-amyloid fibrils. Proc Natl Acad Sci U S A (2009) 1.49
Two-dimensional infrared spectra of the 13C=18O isotopomers of alanine residues in an alpha-helix. J Phys Chem B (2005) 1.47
Dynamics of amide-I modes of the alanine dipeptide in D2O. J Phys Chem B (2005) 1.29
Dual-frequency 2D-IR spectroscopy heterodyned photon echo of the peptide bond. Proc Natl Acad Sci U S A (2003) 1.27
Tidal surge in the M2 proton channel, sensed by 2D IR spectroscopy. Proc Natl Acad Sci U S A (2011) 1.27
Snapshot of the equilibrium dynamics of a drug bound to HIV-1 reverse transcriptase. Nat Chem (2013) 1.24
Seeing the light: preassembly and ligand-induced changes of the interferon gamma receptor complex in cells. Mol Cell Proteomics (2002) 1.18
Residue-specific vibrational echoes yield 3D structures of a transmembrane helix dimer. Science (2011) 1.17
2D-IR experiments and simulations of the coupling between amide-I and ionizable side chains in proteins: application to the Villin headpiece. J Phys Chem B (2009) 1.17
Amide vibrations are delocalized across the hydrophobic interface of a transmembrane helix dimer. Proc Natl Acad Sci U S A (2006) 1.17
Vibrational coupling, isotopic editing, and beta-sheet structure in a membrane-bound polypeptide. J Am Chem Soc (2004) 1.15
2D IR photon echo of azido-probes for biomolecular dynamics. Phys Chem Chem Phys (2010) 1.15
The Two Dimensional Vibrational Echo of a Nitrile Probe of the Villin HP35 Protein. J Phys Chem Lett (2010) 1.15
Energy and electron transfer in enhanced two-photon-absorbing systems with triplet cores. J Phys Chem A (2007) 1.14
Ultrafast vibrational spectroscopy of a degenerate mode of guanidinium chloride. J Phys Chem B (2009) 1.10
Nature of structural inhomogeneities on folding a helix and their influence on spectral measurements. Proc Natl Acad Sci U S A (2004) 1.10
Probing lipid vesicles by bimolecular association and dissociation trajectories of single molecules. J Am Chem Soc (2006) 1.04
Local structure of beta-hairpin isotopomers by FTIR, 2D IR, and ab initio theory. J Phys Chem B (2006) 1.04
2D IR photon echo spectroscopy reveals hydrogen bond dynamics of aromatic nitriles. Chem Phys Lett (2009) 1.03
Correlation of the vibrations of the aqueous azide ion with the O-H modes of bound water molecules. J Phys Chem B (2007) 1.02
Tetrazine phototriggers: probes for peptide dynamics. Angew Chem Int Ed Engl (2010) 1.01
Controlled bimolecular collisions allow sub-diffraction limited microscopy of lipid vesicles. Phys Chem Chem Phys (2006) 1.00
Water-induced relaxation of a degenerate vibration of guanidinium using 2D IR echo spectroscopy. J Phys Chem B (2010) 0.99
Identification of arginine residues in peptides by 2D-IR echo spectroscopy. J Phys Chem A (2011) 0.99
Preassembly and ligand-induced restructuring of the chains of the IFN-gamma receptor complex: the roles of Jak kinases, Stat1 and the receptor chains. Cell Res (2006) 0.98
Techniques: spectroscopy at a stretch. Nature (2005) 0.98
Dynamic structures of aqueous oxalate and the effects of counterions seen by 2D IR. Phys Chem Chem Phys (2012) 0.96
Motions of single molecules and proteins in trehalose glass. J Am Chem Soc (2003) 0.94
Comparison of linear and 2D IR spectra in the presence of fast exchange. J Phys Chem B (2006) 0.94
Anthracene-BODIPY cassettes: syntheses and energy transfer. Chemistry (2003) 0.93
Two-dimensional infrared spectroscopy displays signatures of structural ordering in peptide aggregates. Biophys J (2006) 0.92
Two-dimensional infrared spectral signature and hydration of the oxalate dianion. J Chem Phys (2011) 0.92
Three-dimensional structures by two-dimensional vibrational spectroscopy. Acc Chem Res (2012) 0.91
Interactions among the components of the interleukin-10 receptor complex. Biochem Biophys Res Commun (2005) 0.91
Nonequilibrium dynamics of helix reorganization observed by transient 2D IR spectroscopy. Proc Natl Acad Sci U S A (2013) 0.90
Multidimensional infrared spectroscopy of the N-H bond motions in formamide. J Chem Phys (2004) 0.89
Anharmonicity of amide modes. J Phys Chem B (2006) 0.89
A peptide's perspective of water dynamics. Chem Phys (2011) 0.89
Syntheses, photophysical properties, and application of through-bond energy-transfer cassettes for biotechnology. Chemistry (2006) 0.89
The 2D IR responses of amide and carbonyl modes in water cannot be described by Gaussian frequency fluctuations. J Phys Chem B (2007) 0.88
Design of amphiphilic protein maquettes: enhancing maquette functionality through binding of extremely hydrophobic cofactors to lipophilic domains. Biochemistry (2005) 0.86
2D IR photon echo study of the anharmonic coupling in the OCN region of phenyl cyanate. Chem Phys Lett (2009) 0.86
Single-molecule imaging of the association of the cell-penetrating peptide Pep-1 to model membranes. Biochemistry (2007) 0.85
Quantum Beats and Coherence Decay in Degenerate States Split by Solvation. J Phys Chem Lett (2013) 0.85
Lipid diffusion from single molecules of a labeled protein undergoing dynamic association with giant unilamellar vesicles and supported bilayers. Langmuir (2008) 0.85
Differential hydration of tricyanomethanide observed by time resolved vibrational spectroscopy. J Phys Chem B (2012) 0.85
Interrogating conformationally dependent electron-transfer dynamics via ultrafast visible pump/IR probe spectroscopy. J Am Chem Soc (2004) 0.84
Di-Cysteine S,S-Tetrazine: A Potential Ultra-fast Photochemical Trigger to Explore the Early Events of Peptide/Protein Folding. J Photochem Photobiol A Chem (2012) 0.84
Design, synthesis, and photochemical validation of peptide linchpins containing the S,S-tetrazine phototrigger. Org Lett (2012) 0.83
Equilibrium exchange processes of the aqueous tryptophan dipeptide. J Phys Chem B (2009) 0.82
Super-resolution microscopy of lipid bilayer phases. J Am Chem Soc (2011) 0.81
Vibrational dynamics of a non-degenerate ultrafast rotor: the (C12,C13)-oxalate ion. J Chem Phys (2013) 0.81
Vibrational dynamics of N-H, C-D, and C=O modes in formamide. J Chem Phys (2006) 0.80
Direct observation of triplet state emission of single molecules: single molecule phosphorescence quenching of metalloporphyrin and organometallic complexes by molecular oxygen and their quenching rate distributions. J Am Chem Soc (2003) 0.80
An ion's perspective on the molecular motions of nanoconfined water: a two-dimensional infrared spectroscopy study. J Phys Chem B (2013) 0.78
Intrinsic structural heterogeneity and long-term maturation of amyloid β peptide fibrils. ACS Chem Neurosci (2013) 0.78
Two-dimensional infrared investigation of N-acetyl tryptophan methyl amide in solution. J Phys Chem B (2007) 0.78
Frequency distribution of the amide-I vibration sorted by residues in amyloid fibrils revealed by 2D-IR measurements and simulations. J Phys Chem B (2012) 0.77
The design and synthesis of alanine-rich α-helical peptides constrained by an S,S-tetrazine photochemical trigger: a fragment union approach. J Org Chem (2013) 0.76
High-resolution optical imaging from trajectory time distributions. J Phys Chem B (2006) 0.75