Citation Impact
Citing Papers
Biomedically-relevant metal organic framework-hydrogel composites
2023 StandoutNobel
Analysis of vibrational spectra of 2 and 3-methylpiperidine based on density functional theory calculations
2009
Energies, structures, and electronic properties of molecules in solution with the C‐PCM solvation model
2003 Standout
The 1.76 Å Resolution Crystal Structure of Glycogen Phosphorylase b Complexed with Glucose, and CP320626, a Potential Antidiabetic Drug
2002
The Amber biomolecular simulation programs
2005 Standout
Metal Nanoparticles and Supramolecular Macrocycles: A Tale of Synergy
2014
The distribution of microplastics in soil aggregate fractions in southwestern China
2018 Standout
Exploring protein native states and large‐scale conformational changes with a modified generalized born model
2004 Standout
GLYCAM06: A generalizable biomolecular force field. Carbohydrates
2007 Standout
The spectroscopic (FT-IR, FT-IR gas phase, FT-Raman and UV) and NBO analysis of 4-Hydroxypiperidine by density functional method
2009 Standout
Innovative methods in soil phosphorus research: A review
2015
Ab Initio Evaluation of the Potential Surface for General Base- Catalyzed Methanolysis of Formamide: A Reference Solution Reaction for Studies of Serine Proteases
2000 StandoutNobel
Calculations of Hydration Entropies of Hydrophobic, Polar, and Ionic Solutes in the Framework of the Langevin Dipoles Solvation Model
1999 StandoutNobel
Intrinsic Conformational Preferences of Substituted Cyclohexanes and Tetrahydropyrans Evaluated at the CCSD(T) Complete Basis Set Limit: Implications for the Anomeric Effect
2005
Continuous surface charge polarizable continuum models of solvation. I. General formalism
2010 Standout
Structure and Nanostructure in Ionic Liquids
2015 Standout
An In Situ Procedure for the Preparation of Zeolitic Imidazolate Framework‐8 Polyacrylamide Hydrogel for Adsorption of Aqueous Pollutants
2019
Water as an Active Constituent in Cell Biology
2007 Standout
Nanozymes: Classification, Catalytic Mechanisms, Activity Regulation, and Applications
2019 Standout
Time-dependent density functional theory for molecules in liquid solutions
2001 Standout
State of the Art and Prospects in Metal–Organic Framework (MOF)-Based and MOF-Derived Nanocatalysis
2019 Standout
Nanorattle Au@PtAg encapsulated in ZIF-8 for enhancing CO2 photoreduction to CO
2018
Conformational structure of room temperature ionic liquid N-butyl-N-methyl-pyrrolidinium bis(trifluoromethanesulfonyl) imide — Raman spectroscopic study and DFT calculations
2006
Cucurbituril-Based Molecular Recognition
2015 Standout
Raman spectroscopy: techniques and applications in the life sciences
2017
Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics
1999 Standout
The Origin of Chalcogen-Bonding Interactions
2017 Standout
Controllable Synthesis of SERS-Active Magnetic Metal–Organic Framework-Based Nanocatalysts and Their Application in Photoinduced Enhanced Catalytic Oxidation
2018
Carbon capture and conversion using metal–organic frameworks and MOF-based materials
2019 StandoutNobel
Single Crystals Heterogeneity Impacts the Intrinsic and Extrinsic Properties of Metal–Organic Frameworks
2021 StandoutNobel
Individually Encapsulated Frame-in-Frame Structure
2020 StandoutNobel
Solvent dramatically affects protein structure refinement
2008 StandoutNobel
New developments in the polarizable continuum model for quantum mechanical and classical calculations on molecules in solution
2002 Standout
Fluorine in medicinal chemistry: Recent therapeutic applications of fluorinated small molecules
2006 Standout
Spectroscopy, microscopy, diffraction and scattering of archetypal MOFs: formation, metal sites in catalysis and thin films
2020
Noble metal (Pt, Au@Pd) nanoparticles supported on metal organic framework (MOF-74) nanoshuttles as high-selectivity CO2 conversion catalysts
2019
MOLCAS: a program package for computational chemistry
2003 Standout
Controlled growth and shape-directed self-assembly of gold nanoarrows
2017
Hybridization of Emerging Crystalline Porous Materials: Synthesis Dimensionality and Electrochemical Energy Storage Application
2021 StandoutNobel
Near‐Infrared‐II Plasmonic Trienzyme‐Integrated Metal–Organic Frameworks with High‐Efficiency Enzyme Cascades for Synergistic Trimodal Oncotherapy
2022
Baird’s Rule in Substituted Fulvene Derivatives: An Information-Theoretic Study on Triplet-State Aromaticity and Antiaromaticity
2018
Distinguishing Bonds
2016 Nobel
Fast solvent screening via quantum chemistry: COSMO‐RS approach
2002 Standout
A comprehensive electron wavefunction analysis toolbox for chemists, Multiwfn
2024 Standout
Stereoelectronic Effects and General Trends in Hyperconjugative Acceptor Ability of σ Bonds
2002
Tuning Metal–Organic Framework Nanocrystal Shape through Facet-Dependent Coordination
2020
Metal–organic frameworks meet metal nanoparticles: synergistic effect for enhanced catalysis
2017 Standout
Toward an Experimental Quantum Chemistry: Exploring a New Energy Partitioning
2015 Nobel
From Molecules to Frameworks to Superframework Crystals
2021 StandoutNobel
Core–Shell Gold Nanorod@Zirconium-Based Metal–Organic Framework Composites as in Situ Size-Selective Raman Probes
2019
Ground-State Tautomerism and Excited-State Proton-Transfer Processes in 4,5-Dimethyl-2-(2‘-hydroxyphenyl)imidazole in Solution: Fluorescence Spectroscopy and Quantum Mechanical Calculations
1998
Anti-Stokes excitation of solid-state quantum emitters for nanoscale thermometry
2019 StandoutNobel
Vibrational spectra and molecular structure of 3-(piperidine-1-yl-methyl)-1,3-benzoxazol-2(3H)-one molecule by density functional theory and Hartree–Fock calculations
2009
Evaluation of Models of Electrostatic Interactions in Proteins
2003 StandoutNobel
Quantum Mechanical Continuum Solvation Models
2005 Standout
Accurate Prediction of Band Gaps in Neutral Heterocyclic Conjugated Polymers
2002
Applications of Fluorine in Medicinal Chemistry
2015 Standout
CF2H, a Hydrogen Bond Donor
2017 Standout
Photothermal Nanomaterials: A Powerful Light-to-Heat Converter
2023 Standout
Colloidal metal–organic framework particles: the pioneering case of ZIF-8
2019
The Mechanism of Proton Transfer between Adjacent Sites Exposed to Water
2005
Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions
2009 Standout
Molecular structure and vibrational spectra of piperidine and 4-methylpiperidine by density functional theory and ab initio Hartree–Fock calculations
2007
Natural transition orbitals
2003 Standout
Works of Ignacio Pérez‐Juste being referenced
Pillar[5]arene‐Mediated Synthesis of Gold Nanoparticles: Size Control and Sensing Capabilities
2014
Detection and imaging of quorum sensing in Pseudomonas aeruginosa biofilm communities by surface-enhanced resonance Raman scattering
2016
Structural Characterization of Anion–Calcium–Humate Complexes in Phosphate‐based Fertilizers
2013
Aromaticity in spin-polarized systems: Can rings be simultaneously alpha aromatic and beta antiaromatic?
2008
Encapsulation of Single Plasmonic Nanoparticles within ZIF‐8 and SERS Analysis of the MOF Flexibility
2016
Influence of water in the tautomerism of 2,2′-bipyridine-3,3′-diol
1996
Shape control in ZIF-8 nanocrystals and metal nanoparticles@ZIF-8 heterostructures
2017
Ab Initio Study of the Axial/Equatorial Equilibrium in N- and O-Containing Rings in Gas Phase and Aqueous Solution: 1-Oxa-3-aza-, 1-Oxa-3,5-diaza-, 1,3-Dioxa-5-azacyclohexanes and N-Methyl Derivatives
1997
Ab Initio Study and NBO Interpretation of the Anomeric Effect in CH2(XH2)2(X = N, P, As) Compounds
2000
Ab initio study of the pseudorotation and conformational stability of pyrrolidine
1998
Theoretical Study of Pyrrolidine: Revised Conformational Energies and Vibrational Assignments
2002
Influence of calculation level and effect of methylation on axial/equatorial equilibria in piperidines
1998
Electronegativity estimator built on QTAIM‐based domains of the bond electron density
2014