Citation Impact
Citing Papers
Molecular basis for SH3 domain regulation of F-BAR–mediated membrane deformation
2010
Membrane curvature regulates the spatial distribution of bulky glycoproteins
2022 StandoutNobel
Microenvironmental modulation breaks intrinsic pH limitations of nanozymes to boost their activities
2024 StandoutNobel
LAMMPS - a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales
2021 Standout
GROMACS: Fast, flexible, and free
2005 Standout
Atomic packing and short-to-medium-range order in metallic glasses
2006 StandoutNature
Hydrophobic mismatch drives self-organization of designer proteins into synthetic membranes
2024 StandoutNobel
Highly efficient organic light-emitting diodes from delayed fluorescence
2012 StandoutNature
Systematic coarse-graining of molecular models by the Newton inversion method
2009
Experimental Evidence for Quantum Interference and Vibrationally Induced Decoherence in Single-Molecule Junctions
2012 StandoutNobel
Nucleotide-Dependent Lateral and Longitudinal Interactions in Microtubules
2013
Scalable molecular dynamics with NAMD
2005 Standout
High-Resolution Microtubule Structures Reveal the Structural Transitions in αβ-Tubulin upon GTP Hydrolysis
2014 StandoutNobel
Uniquantal Release through a Dynamic Fusion Pore Is a Candidate Mechanism of Hair Cell Exocytosis
2014 StandoutNobel
Torsion angle dynamics for NMR structure calculation with the new program Dyana
1997 StandoutNobel
Chemisorptive Luminescence: Oxygen on Si(111) Surfaces
1971 StandoutNobel
The surface constraint all atom model provides size independent results in calculations of hydration free energies
1998 StandoutNobel
Spectroscopic Investigation of the Mechanism of the Intramolecular Heavy Atom Effect on the Phosphorescence Process. I. Naphthalene Emission
1964
Investigation of charge-transfer complexes by computer simulation. I. Iodine in benzene solution
1992
Coarse-graining entropy, forces, and structures
2011
Structural Changes Accompanying Intramolecular Electron Transfer: Focus on Twisted Intramolecular Charge-Transfer States and Structures
2003 Standout
Extended Hückel Theory. II. σ Orbitals in the Azines
1964 StandoutNobel
Computer Simulation of Liquids
2017 Standout
Polarization of the π*→π and π*→n Phosphorescence Spectra of N-Heterocyclics
1963
Charge Photogeneration in Organic Solar Cells
2010 Standout
Ground X 2Σ+ state potential well, and excited state dynamics of diatomic XeF in solid Ne and Ar
1976 StandoutNobel
Femtosecond reaction dynamics in the gas-to-liquid transition region: Observation of a three-phase density dependence
1996 StandoutNobel
Keeping the shape but changing the charges: A simulation study of urea and its iso-steric analogs
1996 StandoutNobel
The multiscale coarse-graining method. VI. Implementation of three-body coarse-grained potentials
2010
Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics
1999 Standout
Conceptual Density Functional Theory
2003 Standout
The multiscale coarse-graining method. II. Numerical implementation for coarse-grained molecular models
2008
Optical and Magnetic Field Studies of the Lowest Triplet State of the Pyrazine Crystal
1970
Resonance enhanced two-photon ionization studies in a supersonic molecular beam: Bromobenzene and iodobenzene
1980 StandoutNobel
Improved Parameters for the Martini Coarse-Grained Protein Force Field
2012
Umwandlung von Elektronenanregungsenergie
1961
Spin-quantization and spin–orbit coupling effects on the line shapes of triplet states. II. The ‘‘small’’ exciton problem
1980 StandoutNobel
Zero field optically detected magnetic resonance of multiple localized states in 1,4-dibromonaphthalene crystals
1975 StandoutNobel
Hydrogen Bond versus Polar Effects: An Ab Initio Analysis on n → π* Absorption Spectra and N Nuclear Shieldings of Diazines in Solution
2002
Versatile Object-Oriented Toolkit for Coarse-Graining Applications
2009
A self consistent field molecular orbital treatment, including excited states of cyclopropane, ethylene oxide and ethylenimine
1968
On the phosphorescence capability of nπ* states
1972
Two-dimensional spectroscopy. Application to nuclear magnetic resonance
1976 StandoutNobel
Studies of the 3455- Å Triplet State of s-Triazine
1971 StandoutNobel
Exciton Dynamics in Poly(p-Pyridyl Vinylene)
1996 StandoutNobel
The nature of the lowest triplet state of cinnoline
1974
Radiationless Paths in the Diazines
1967
Fluorescence excitation spectrum of s-tetrazine cooled in a supersonic free jet: Van der waals complexes and isotopic species
1978 StandoutNobel
Electronic structure and dynamics of tunable laser excited p-benzoquinone (-h4 and -d4) in the gas phase
1973 StandoutNobel
Plasmons in Strongly Coupled Metallic Nanostructures
2011 Standout
n → π Transitions in the azines
1961
Phosphorescence from pyrimidine vapor
1980
Nature of s-Tetrazine Emission Spectra
1963
An a b i n i t i o study of the phosphorescence and intersystem crossing of the lowest triplet state of pyrazine
1977
Energy localization in substitutionally disordered solids. II. Studies by optical and optically detected magnetic resonance spectroscopy
1980 StandoutNobel
Spin–Orbit Coupling in Aromatic Hydrocarbons. Analysis of Nonradiative Transitions between Singlet and Triplet States in Benzene and Naphthalene
1971
On the Multiplicity of the Phosphorescent State of Organic Molecules
1966
Fluorescence of s-Tetrazine
1962
Synthesis, structure and thermal decomposition of nitrogen–iodine charge-transfer complexes
1997
Hydrogen-bond kinetics in liquid water
1996 StandoutNature
Molecular orbital theory of the hydrogen bond.
1976
Optical and Photoelectron Spectra of Small Rings. III. The Saturated Three-Membered Rings
1969
Solvatochromatic shifts studied by multi-configuration self-consistent reaction field theory. Application to azabenzenes
1992
Near ultraviolet n - π transitions of the pyrazine molecule. I. The singlet n - π state and the ground state
1974
Spin-orbit coupling in aromatic molecules
1970
Ground and n–π* excited state structures of the hydrogen bonded complexes pyrazine⋅H2O and pyrazine⋅ (H2O)2
1979 StandoutNobel
Canonical sampling through velocity rescaling
2007 Standout
Vibronic Spin–Orbit Interaction in the Phosphorescence Spectrum of Phenazine
1969
Collision-Induced Absorption Spectrum of Gaseous Oxygen at Low Temperatures and Pressures. II. The Simultaneous Transitions Δg1 + 1Δg ← 3Σg− + 3Σg− and Δg1 + 1Σg+ ← 3Σg− + 3Σg−
1969
Molecular transport junctions: vibrational effects
2007
Interaction of orbitals through space and through bonds
1971 StandoutNobel
The Halogen Bond
2016 Standout
The magnetic rotation spectrum of singlet-triplet transitions
1961
Excited state electronic structure and dynamics in sym -tetrazine vapor
1973 StandoutNobel
Distant intramolecular interaction between identical chromophores: The n-π* excited states of p-benzoquinone
1978 StandoutNobel
Stark effects and electric dipole coupling ofnπ* and ππ* states
1972
Spin—Orbit Coupling and the Radiationless Processes in Nitrogen Heterocyclics
1963
Intramolecular vibrational relaxation: Effects on electronic nonradiative relaxation rates
1983 StandoutNobel
Quantum Mechanical Continuum Solvation Models
2005 Standout
Fast Parallel Algorithms for Short-Range Molecular Dynamics
1995 Standout
Radiative and radiationless transition phenomena in 1,4-, 1,3-, and 1,2-diazanaphthalene vapors
1974 StandoutNobel
5350-Å Singlet-Triplet Transition in p-Benzoquinone
1965
Femtosecond real-time probing of reactions. XXI. Direct observation of transition-state dynamics and structure in charge-transfer reactions
1996 StandoutNobel
Analysis of vibrational structure and Jahn-Teller effects in the electron spectrum of ammonia
1973 StandoutNobel
Two Synthesizer Nuclear Spin Decoupling; INDOR Spectra of C13F3COOH and CF3C13OOH, N14H4+, and (CH3)4Si29
1962
Radiationless relaxation and optical dephasing of molecules excited by wide- and narrow-band lasers. II. Pentacene in low-temperature mixed crystals
1979 StandoutNobel
Spin−Orbit Coupling and Intersystem Crossing in Conjugated Polymers: A Configuration Interaction Description
2001
Electronic states of azabenzenes: A critical review
1967
A smooth particle mesh Ewald method
1995 Standout
Works of Vinod Krishna being referenced
A Systematic Methodology for Defining Coarse-Grained Sites in Large Biomolecules
2008
Role of Protein Interactions in Defining HIV-1 Viral Capsid Shape and Stability: A Coarse-Grained Analysis
2010
New Insights into BAR Domain-Induced Membrane Remodeling
2009
Singlet–Triplet Transition Probabilities in Aromatic Hydrocarbons. I. A→31La Transitions in Linear Polyacenes
1969
Polarization of Triplet→Singlet Emission Spectra
1961 Nature
Vibrational lifetimes of molecular adsorbates on metal surfaces
2006
A generalized mean field theory of coarse-graining
2011
CHARGE TRANSFER INTERACTION BETWEEN IODINE AND AZINES: IONIZATION POTENTIALS OF AZINES1
1963
Spin-Orbit Coupling in Azines
1963
Role of Ground State in Singlet—Triplet Transition Probabilities
1962
Polarization of Triplet→Singlet Transitions in Polyacenes
1962
Excited Electronic States of Cyclopropane
1966
Polarization of T→S Emission Spectra of Azines
1962
The multiscale coarse-graining method. I. A rigorous bridge between atomistic and coarse-grained models
2008
The multiscale coarse-graining method. IV. Transferring coarse-grained potentials between temperatures
2009
Charge transfer intensities of iodine complexes with N-heterocyclics
1968
Protonation Effects on n → π* Transitions in Pyrimidine1
1961
Solvent Effects on n→π Transitions in Pyrazine
1960