Citation Impact
Citing Papers
Chemistry of Soft Porous Crystals: Structural Dynamics and Gas Adsorption Properties
2020 StandoutNobel
Designing Fluorinated Cinchona Alkaloids for Enantioselective Catalysis: Controlling Internal Rotation by a Fluorine‐Ammonium Ion gauche Effect (φNCCF)
2012
Synthesis, Conformation and Biological Evaluation of the Enantiomers of 3‐Fluoro‐γ‐Aminobutyric Acid ((R)‐ and (S)‐3F‐GABA): An Analogue of the Neurotransmitter GABA
2007
Multiwfn: A multifunctional wavefunction analyzer
2011 Standout
Evaluation of the intramolecular basis set superposition error in the calculations of larger molecules: [n]helicenes and Phe‐Gly‐Phe tripeptide
2007
Understanding organofluorine chemistry. An introduction to the C–F bond
2007 Standout
A New Approach to Solution‐Phase Gold Seeding for SERS Substrates
2011
On the Importance of Electron Correlation Effects for the π‐π Interactions in Cyclophanes
2004
Accurate description of van der Waals complexes by density functional theory including empirical corrections
2004 Standout
Fundamental Gaps in Finite Systems from Eigenvalues of a Generalized Kohn-Sham Method
2010
Catalysis for fluorination and trifluoromethylation
2011 StandoutNature
The C–F bond as a conformational tool in organic and biological chemistry
2010
Early Palliative Care for Patients with Metastatic Non–Small-Cell Lung Cancer
2010 Standout
Colorectal cancer
2013 Standout
Stereoselective Fluorination Alters the Geometry of a Cyclic Peptide: Exploration of Backbone‐Fluorinated Analogues of Unguisin A
2014
Fluorine Conformational Effects in Organocatalysis: An Emerging Strategy for Molecular Design
2011
Density functional theory with dispersion corrections for supramolecular structures, aggregates, and complexes of (bio)organic molecules
2007
London Dispersion in Molecular Chemistry—Reconsidering Steric Effects
2015
Colorectal cancer
2019 Standout
3‐Fluoro‐N‐methyl‐D ‐aspartic acid (3F‐NMDA) Stereoisomers as Conformational Probes for Exploring Agonist Binding at NMDA Receptors
2012
The vicinal F–C–C–F moiety as a tool for influencing peptide conformation
2005
MRI directed multidisciplinary team preoperative treatment strategy: the way to eliminate positive circumferential margins?
2006
DNA Base Trimers: Empirical and Quantum Chemical Ab Initio Calculations versus Experiment in Vacuo
2006
A Multivariate Analysis of Preoperative Risk Factors in Patients with Common Bile Duct Stones
1989
Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential
2009 Standout
The Fluorine‐Iminium Ion Gauche Effect: Proof of Principle and Application to Asymmetric Organocatalysis
2009
Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction
2006 Standout
A prognostic model for predicting survival in cirrhosis with ascites
2001
Hyponatremia and Mortality among Patients on the Liver-Transplant Waiting List
2008 Standout
Conformational preferences and basicities of monofluorinated cyclopropyl amines in comparison to cyclopropylamine and 2-fluoroethylamine
2008
How Uncommon are Isolated Lung Metastases in Colorectal Cancer? A Review from Database of 754 Patients Over 4 Years
2008
Complications of Endoscopic Biliary Sphincterotomy
1996 Standout
The preferred all-gauche conformations in 3-fluoro-1,2-propanediol
2013
An Unexpected and Significantly Lower Hydrogen‐Bond‐Donating Capacity of Fluorohydrins Compared to Nonfluorinated Alcohols
2012
Glypican-1 identifies cancer exosomes and detects early pancreatic cancer
2015 StandoutNature
Early colon cancer: ESMO Clinical Practice Guidelines for diagnosis, treatment and follow-up
2013
Capecitabine and Oxaliplatin for Advanced Esophagogastric Cancer
2008 Standout
Chemotherapy with Preoperative Radiotherapy in Rectal Cancer
2006 Standout
Effect of the damping function in dispersion corrected density functional theory
2011 Standout
An ultrafast rechargeable aluminium-ion battery
2015 StandoutNature
Stereoselective hydrofluorination of ynamides: a straightforward synthesis of novel α-fluoroenamides
2012
Ascites and hepatorenal syndrome in cirrhosis: pathophysiological basis of therapy and current management
2003
Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data
2009 Standout
Ring Expansion Induced by DAST: Synthesis of Substituted 3‐Fluoropiperidines from Prolinols and 3‐Fluoroazepanes from 2‐Hydroxymethylpiperidines
2007
ASCO 2006 Update of Recommendations for the Use of Tumor Markers in Gastrointestinal Cancer
2006
Pushing the frontiers of density functionals by solving the fractional electron problem
2021 StandoutScienceNobel
Monofluorination of Organic Compounds: 10 Years of Innovation
2015 Standout
Semiempirical hybrid functional with improved performance in an extensive chemical assessment
2005
3d Transition Metals for C–H Activation
2018 Standout
Fluorine in medicinal chemistry
2007 Standout
Using dispersion-corrected density functional theory to understand supramolecular binding thermodynamics
2014
Fluorine in Pharmaceutical Industry: Fluorine-Containing Drugs Introduced to the Market in the Last Decade (2001–2011)
2013 Standout
The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals
2007 Standout
A Tripodal Molecule on a Gold Surface: Orientation-Dependent Coupling and Electronic Properties of the Molecular Legs
2013 StandoutNobel
Copper Active Sites in Biology
2014 Standout
Mapping of Functional Groups in Metal-Organic Frameworks
2013 StandoutScienceNobel
Supramolecular Double-Helix Formation by Diastereoisomeric Conformations of Configurationally Enantiomeric Macrocycles
2016 StandoutNobel
Asymptotic correction of the exchange–correlation kernel of time-dependent density functional theory for long-range charge-transfer excitations
2004
Functionalization of Graphene: Covalent and Non-Covalent Approaches, Derivatives and Applications
2012 Standout
A DFT study on the origin of the fluorine gauche effect in substituted fluoroethanes
2010
Improving Predictions of Gas Adsorption in Metal–Organic Frameworks with Coordinatively Unsaturated Metal Sites: Model Potentials, ab initio Parameterization, and GCMC Simulations
2012
Comparison of DFT Methods for Molecular Orbital Eigenvalue Calculations
2007
Challenges for Density Functional Theory
2011 Standout
Unveiling the Delicate Balance of Steric and Dispersion Interactions in Organocatalysis Using High-Level Computational Methods
2020 StandoutNobel
Shielding Constants and Chemical Shifts in DFT: Influence of Optimized Effective Potential and Coulomb-Attenuation
2010
Next Generation of Fluorine-Containing Pharmaceuticals, Compounds Currently in Phase II–III Clinical Trials of Major Pharmaceutical Companies: New Structural Trends and Therapeutic Areas
2016 Standout
Functional Nanomaterials for Phototherapies of Cancer
2014 Standout
Precise Modulation of CO2 Sorption in Ti8Ce2–Oxo Clusters: Elucidating Lewis Acidity of the Ce Metal Sites and Structural Flexibility
2024 StandoutNobel
Disease-Free Survival Versus Overall Survival As a Primary End Point for Adjuvant Colon Cancer Studies: Individual Patient Data From 20,898 Patients on 18 Randomized Trials
2005
Interpretation of the Ultrafast Photoinduced Processes in Pentacene Thin Films
2010
Exchange representations in Kohn–Sham NMR shielding calculations
2003
Helicenes: Synthesis and Applications
2011 Standout
Strong Light-Matter Interactions in Heterostructures of Atomically Thin Films
2013 StandoutScienceNobel
Neoadjuvant Capecitabine and Oxaliplatin Followed by Synchronous Chemoradiation and Total Mesorectal Excision in Magnetic Resonance Imaging–Defined Poor-Risk Rectal Cancer
2006
Relationship between long-range charge-transfer excitation energy error and integer discontinuity in Kohn–Sham theory
2003
Supramolecular Explorations: Exhibiting the Extent of Extended Cationic Cyclophanes
2016 StandoutNobel
Electron Injection from Copper Diimine Sensitizers into TiO2: Structural Effects and Their Implications for Solar Energy Conversion Devices
2015 StandoutNobel
Exchange-hole dipole moment and the dispersion interaction
2005
Dispersion interactions in density‐functional theory
2009
A consistent and accurateab initioparametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
2010 Standout
Highly Accurate First-Principles Benchmark Data Sets for the Parametrization and Validation of Density Functional and Other Approximate Methods. Derivation of a Robust, Generally Applicable, Double-Hybrid Functional for Thermochemistry and Thermochemical Kinetics
2008
Carbon Nanomaterials for Biological Imaging and Nanomedicinal Therapy
2015 Standout
Assessment of the Performance of the M05−2X and M06−2X Exchange-Correlation Functionals for Noncovalent Interactions in Biomolecules
2008
Transition metal NMR chemical shifts from optimized effective potentials
2007
Catalytic Asymmetric Epoxidation of α-Branched Enals
2010 StandoutNobel
Aromatic Trifluoromethylation with Metal Complexes
2011 Standout
Machine learning models of the energy curvature vs particle number for optimal tuning of long-range corrected functionals
2020
Spin-component scaled second-order Møller–Plesset perturbation theory for the calculation of molecular geometries and harmonic vibrational frequencies
2004
Orbital-dependent density functionals: Theory and applications
2008
Multivariate Prognostic Factor Analysis in Locally Advanced and Metastatic Esophago-Gastric Cancer—Pooled Analysis From Three Multicenter, Randomized, Controlled Trials Using Individual Patient Data
2004
Selective Anti-Markovnikov Cyclization and Hydrofluorination Reaction in Superacid HF/SbF5: A Tool in the Design of Nitrogen-Containing (Fluorinated) Polycyclic Systems
2013
Quality of Life Supersedes the Classic Prognosticators for Long-Term Survival in Locally Advanced Non–Small-Cell Lung Cancer: An Analysis of RTOG 9801
2009
Applications of Fluorine in Medicinal Chemistry
2015 Standout
Mechanisms of Pulsed Laser Ablation of Biological Tissues
2003 Standout
Revealing Noncovalent Interactions
2010 Standout
Absorption of CO2 and CS2 into the Hofmann-Type Porous Coordination Polymer: Electrostatic versus Dispersion Interactions
2013 StandoutNobel
Excitation energies in density functional theory: An evaluation and a diagnostic test
2008
Photoionization of aqueous indole: Conduction band edge and energy gap in liquid water
1979
Singlet Fission
2010 Standout
A semiempirical generalized gradient approximation exchange-correlation functional
2004
Stereoselective Fluorination Alters the Geometry of a Cyclic Peptide: Exploration of Backbone‐Fluorinated Analogues of Unguisin A
2014
Synopsis of Some Recent Tactical Application of Bioisosteres in Drug Design
2011 Standout
Enantiomers of 4-Amino-3-fluorobutanoic Acid as Substrates for γ-Aminobutyric Acid Aminotransferase. Conformational Probes for GABA Binding
2007
Single-Reference ab Initio Methods for the Calculation of Excited States of Large Molecules
2005 Standout
Works of Mark Allen being referenced
Peritoneovenous Shunting as Compared with Medical Treatment in Patients with Alcoholic Cirrhosis and Massive Ascites
1989
The observation of a large gauche preference when 2-fluoroethylamine and 2-fluoroethanol become protonated
2004
Neoadjuvant systemic fluorouracil and mitomycin C prior to synchronous chemoradiation is an effective strategy in locally advanced rectal cancer
2003
Baseline quality of life predicts survival in patients with advanced colorectal cancer
2002
Energy of Excess Electrons in Nonpolar Liquids by Photoelectric Work Function Measurements
1971
Improved NMR chemical shifts in density functional theory
2003
Rapid Dissolution of Gallstones by Methyl Tert-Butyl Ether
1985
Helium dimer dispersion forces and correlation potentials in density functional theory
2002
The Value of Routine Serum Carcino-Embryonic Antigen Measurement and Computed Tomography in the Surveillance of Patients After Adjuvant Chemotherapy for Colorectal Cancer
2004
Eigenvalues, integer discontinuities and NMR shielding constants in Kohn—Sham theory
2002
Kohn–Sham calculations using hybrid exchange-correlation functionals with asymptotically corrected potentials
2000