Citation Impact
Citing Papers
Characterizing and explaining the impact of disease-associated mutations in proteins without known structures or structural homologs
2022 StandoutNobel
Comprehensive computational design of ordered peptide macrocycles
2017 StandoutScienceNobel
In Situ Thermal Atomization To Convert Supported Nickel Nanoparticles into Surface‐Bound Nickel Single‐Atom Catalysts
2018
GROMACS: Fast, flexible, and free
2005 Standout
Atomic packing and short-to-medium-range order in metallic glasses
2006 StandoutNature
Folding of a model three-helix bundle protein: a thermodynamic and kinetic analysis 1 1Edited by A. R. Fersht
1999 StandoutNobel
Anchor extension: a structure-guided approach to design cyclic peptides targeting enzyme active sites
2021 StandoutNobel
Scalable molecular dynamics with NAMD
2005 Standout
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
Uniquantal Release through a Dynamic Fusion Pore Is a Candidate Mechanism of Hair Cell Exocytosis
2014 StandoutNobel
Protein–Protein Docking with Simultaneous Optimization of Rigid-body Displacement and Side-chain Conformations
2003 StandoutNobel
Generalized Fluctuation-Dissipation Relation and Effective Temperature Upon Heating a Deeply Supercooled Liquid
2013 StandoutNobel
Torsion angle dynamics for NMR structure calculation with the new program Dyana
1997 StandoutNobel
A Novel Algorithm for Non-Bonded-List Updating in Molecular Simulations
2006
A review on fundamentals for designing oxygen evolution electrocatalysts
2020 Standout
Exploring Indium‐Based Ternary Thiospinel as Conceivable High‐Potential Air‐Cathode for Rechargeable Zn–Air Batteries
2018 StandoutNobel
The surface constraint all atom model provides size independent results in calculations of hydration free energies
1998 StandoutNobel
High‐Performance Metal‐Free Nanosheets Array Electrocatalyst for Oxygen Evolution Reaction in Acid
2020
Emerging Engineered Wood for Building Applications
2022 Standout
Efficient particle labeling in atomistic simulations
2007
Nonprecious Metal Catalysts for Oxygen Reduction in Heterogeneous Aqueous Systems
2018
Transport in Proton Conductors for Fuel-Cell Applications: Simulations, Elementary Reactions, and Phenomenology
2004 Standout
Transparent Wood Film Incorporating Carbon Dots as Encapsulating Material for White Light-Emitting Diodes
2018
Computer Simulation of Liquids
2017 Standout
A flexible algorithm for calculating pair interactions on SIMD architectures
2013
Femtosecond reaction dynamics in the gas-to-liquid transition region: Observation of a three-phase density dependence
1996 StandoutNobel
Homogenized Bimetallic Catalysts from Metal–Organic Framework Alloys
2019 StandoutNobel
Nanozymes: Classification, Catalytic Mechanisms, Activity Regulation, and Applications
2019 Standout
Calculating Structures and Free Energies of Complex Molecules: Combining Molecular Mechanics and Continuum Models
2000 Standout
Tailored Porous Materials
1999 StandoutNobel
State of the Art and Prospects in Metal–Organic Framework (MOF)-Based and MOF-Derived Nanocatalysis
2019 Standout
Recent Progress in Metal‐Organic Frameworks for Applications in Electrocatalytic and Photocatalytic Water Splitting
2017
Keeping the shape but changing the charges: A simulation study of urea and its iso-steric analogs
1996 StandoutNobel
GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation
2008 Standout
Unimpeded Permeation of Water Through Helium-Leak–Tight Graphene-Based Membranes
2012 StandoutScienceNobel
Reversible multiple time scale molecular dynamics
1992 Standout
Water electrolysis: from textbook knowledge to the latest scientific strategies and industrial developments
2022 Standout
Oxidase-mimicking activity of the nitrogen-doped Fe3C@C composites
2017
Emerging Two-Dimensional Nanomaterials for Electrocatalysis
2018 Standout
B, N Codoped and Defect‐Rich Nanocarbon Material as a Metal‐Free Bifunctional Electrocatalyst for Oxygen Reduction and Evolution Reactions
2018
Constant pressure molecular dynamics simulation: The Langevin piston method
1995 Standout
Carbon capture and conversion using metal–organic frameworks and MOF-based materials
2019 StandoutNobel
How Hydrophobic Buckminsterfullerene Affects Surrounding Water Structure
2008 StandoutNobel
Detailed Hydration Maps of Benzene and Cyclohexane Reveal Distinct Water Structures
2004 StandoutNobel
Nanomaterials with enzyme-like characteristics (nanozymes): next-generation artificial enzymes (II)
2018 Standout
Biomass-derived FeNi alloy and nitrogen-codoped porous carbons as highly efficient oxygen reduction and evolution bifunctional electrocatalysts for rechargeable Zn-air battery
2018
Nanostructured Carbon Based Heterogeneous Electrocatalysts for Oxygen Evolution Reaction in Alkaline Media
2019
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
Dispersion of Carbon Nanotubes in Liquids
2003
Design of Efficient Bifunctional Oxygen Reduction/Evolution Electrocatalyst: Recent Advances and Perspectives
2017
General purpose molecular dynamics simulations fully implemented on graphics processing units
2008 Standout
Canonical sampling through velocity rescaling
2007 Standout
The Role of Defect Sites in Nanomaterials for Electrocatalytic Energy Conversion
2019
GROMACS: High performance molecular simulations through multi-level parallelism from laptops to supercomputers
2015 Standout
Cocatalysts for Selective Photoreduction of CO2into Solar Fuels
2019 Standout
Molecular dynamics simulation of nanoscale liquid flows
2010
A reactive potential for hydrocarbons with intermolecular interactions
2000 Standout
The SIESTA method forab initioorder-Nmaterials simulation
2002 Standout
3D Robust Carbon Aerogels Immobilized with Pd3Pb Nanoparticles for Oxygen Reduction Catalysis
2018
Quantum Mechanical Continuum Solvation Models
2005 Standout
Melt processing and mechanical property characterization of multi-walled carbon nanotube/high density polyethylene (MWNT/HDPE) composite films
2003
Fast Parallel Algorithms for Short-Range Molecular Dynamics
1995 Standout
Co3O4@Co/NCNT Nanostructure Derived from a Dicyanamide‐Based Metal‐Organic Framework as an Efficient Bi‐functional Electrocatalyst for Oxygen Reduction and Evolution Reactions
2017
Chemistry of Carbon Nanotubes
2006 Standout
Metal–Organic‐Framework‐Derived Hollow N‐Doped Porous Carbon with Ultrahigh Concentrations of Single Zn Atoms for Efficient Carbon Dioxide Conversion
2018
Calibration and Testing of a Water Model for Simulation of the Molecular Dynamics of Proteins and Nucleic Acids in Solution
1997 StandoutNobel
Decoupling Oxygen and Chlorine Evolution Reactions in Seawater using Iridium‐based Electrocatalysts
2020
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 Min Cheng being referenced
A 3D bi-functional porous N-doped carbon microtube sponge electrocatalyst for oxygen reduction and oxygen evolution reactions
2016
N-doped carbon nanotubes containing a high concentration of single iron atoms for efficient oxygen reduction
2018
Mechanical properties of carbon nanotube by molecular dynamics simulation
2001
Improved neighbor list algorithm in molecular simulations using cell decomposition and data sorting method
2004
Hierarchically porous Fe-N-doped carbon nanotubes as efficient electrocatalyst for oxygen reduction
2016
Carbon nanotube encapsulated in nitrogen and phosphorus co-doped carbon as a bifunctional electrocatalyst for oxygen reduction and evolution reactions
2018
Atomically Dispersed Transition Metals on Carbon Nanotubes with Ultrahigh Loading for Selective Electrochemical Carbon Dioxide Reduction
2018