Citation Impact
Citing Papers
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
Mechanotransduction and extracellular matrix homeostasis
2014 Standout
CHARMM general force field: A force field for drug‐like molecules compatible with the CHARMM all‐atom additive biological force fields
2009 Standout
Folding of a model three-helix bundle protein: a thermodynamic and kinetic analysis 1 1Edited by A. R. Fersht
1999 StandoutNobel
Multiscale modeling of biological functions
2011 StandoutNobel
Effects of extracellular matrix viscoelasticity on cellular behaviour
2020 StandoutNature
The Amber biomolecular simulation programs
2005 Standout
Membrane protein sequestering by ionic protein–lipid interactions
2011 StandoutNatureNobel
ER Membrane Phospholipids and Surface Tension Control Cellular Lipid Droplet Formation
2017
Rupture mechanism of liquid crystal thin films realized by large-scale molecular simulations
2013
Dynamics and functions of lipid droplets
2018 Standout
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
Efficient computation of three-dimensional protein structures in solution from nuclear magnetic resonance data using the program DIANA and the supporting programs CALIBA, HABAS and GLOMSA
1991 StandoutNobel
The mystery of membrane organization: composition, regulation and roles of lipid rafts
2017 Standout
Uniquantal Release through a Dynamic Fusion Pore Is a Candidate Mechanism of Hair Cell Exocytosis
2014 StandoutNobel
On the origin of the electrostatic barrier for proton transport in aquaporin
2004 StandoutNobel
Polarizable Water Model for the Coarse-Grained MARTINI Force Field
2010
Biomembranes in atomistic and coarse-grained simulations
2015
Real Time FRET Based Detection of Mechanical Stress in Cytoskeletal and Extracellular Matrix Proteins
2010
Interdigitation between Triglycerides and Lipids Modulates Surface Properties of Lipid Droplets
2017
Protein–Protein Docking with Simultaneous Optimization of Rigid-body Displacement and Side-chain Conformations
2003 StandoutNobel
Torsion angle dynamics for NMR structure calculation with the new program Dyana
1997 StandoutNobel
The surface constraint all atom model provides size independent results in calculations of hydration free energies
1998 StandoutNobel
Transport in Proton Conductors for Fuel-Cell Applications: Simulations, Elementary Reactions, and Phenomenology
2004 Standout
Computer Simulation of Liquids
2017 Standout
Femtosecond reaction dynamics in the gas-to-liquid transition region: Observation of a three-phase density dependence
1996 StandoutNobel
Calculating Structures and Free Energies of Complex Molecules: Combining Molecular Mechanics and Continuum Models
2000 Standout
CHARMM‐GUI: A web‐based graphical user interface for CHARMM
2008 Standout
Tailored Porous Materials
1999 StandoutNobel
Keeping the shape but changing the charges: A simulation study of urea and its iso-steric analogs
1996 StandoutNobel
Coarse-Graining Methods for Computational Biology
2013
A Combined Experimental–Computational Investigation of Methane Adsorption and Selectivity in a Series of Isoreticular Zeolitic Imidazolate Frameworks
2013 StandoutNobel
A guiding potential method for evaluating the bending rigidity of tensionless lipid membranes from molecular simulation
2013
Reversible multiple time scale molecular dynamics
1992 Standout
A five-site model for liquid water and the reproduction of the density anomaly by rigid, nonpolarizable potential functions
2000 Standout
Constant pressure molecular dynamics simulation: The Langevin piston method
1995 Standout
How Hydrophobic Buckminsterfullerene Affects Surrounding Water Structure
2008 StandoutNobel
Perspective: Coarse-grained models for biomolecular systems
2013
Detailed Hydration Maps of Benzene and Cyclohexane Reveal Distinct Water Structures
2004 StandoutNobel
Determination of Alkali and Halide Monovalent Ion Parameters for Use in Explicitly Solvated Biomolecular Simulations
2008 Standout
Coarse-Grained Molecular Dynamics Simulations of the Energetics of Helix Insertion into a Lipid Bilayer
2008
Transferable Potentials for Phase Equilibria. 1. United-Atom Description of n-Alkanes
1998 Standout
Constant pressure molecular dynamics algorithms
1994 Standout
Dissipative particle dynamics: Bridging the gap between atomistic and mesoscopic simulation
1997 Standout
Hydrogen-bond kinetics in liquid water
1996 StandoutNature
Canonical sampling through velocity rescaling
2007 Standout
A reactive potential for hydrocarbons with intermolecular interactions
2000 Standout
The SIESTA method forab initioorder-Nmaterials simulation
2002 Standout
Quantum Mechanical Continuum Solvation Models
2005 Standout
Fast Parallel Algorithms for Short-Range Molecular Dynamics
1995 Standout
α-Helix Unwinding as Force Buffer in Spectrins
2018
Development of an improved four-site water model for biomolecular simulations: TIP4P-Ew
2004 Standout
Calibration and Testing of a Water Model for Simulation of the Molecular Dynamics of Proteins and Nucleic Acids in Solution
1997 StandoutNobel
On the energetics of translocon-assisted insertion of charged transmembrane helices into membranes
2010 StandoutNobel
COMPASS: An ab Initio Force-Field Optimized for Condensed-Phase ApplicationsOverview with Details on Alkane and Benzene Compounds
1998 Standout
Simulating the Effect of DNA Polymerase Mutations on Transition-State Energetics and Fidelity: Evaluating Amino Acid Group Contribution and Allosteric Coupling for Ionized Residues in Human Pol β
2006 StandoutNobel
A smooth particle mesh Ewald method
1995 Standout
Works of Mario Orsi being referenced
The ELBA Force Field for Coarse-Grain Modeling of Lipid Membranes
2011
Coarse-grain modelling of DMPC and DOPC lipid bilayers
2010
Mechanical response and conformational changes of alpha-actinin domains during unfolding: a molecular dynamics study
2006
Anisotropic Elastic Network Modeling of Entire Microtubules
2010
Dual-resolution molecular dynamics simulation of antimicrobials in biomembranes
2010
Direct Mixing of Atomistic Solutes and Coarse-Grained Water
2014
A Quantitative Coarse-Grain Model for Lipid Bilayers
2007
Effects of Lipid Composition on Bilayer Membranes Quantified by All-Atom Molecular Dynamics
2015