Citation Impact
Citing Papers
Comprehensive computational design of ordered peptide macrocycles
2017 StandoutScienceNobel
Increased Lipophilicity and Subsequent Cell Partitioning Decrease Passive Transcellular Diffusion of Novel, Highly Lipophilic Antioxidants
1999 StandoutNobel
Industrial biocatalysis today and tomorrow
2001 StandoutNature
Continuum and discrete calculation of fractional contributions to solvation free energy
2003
The influence of drug-like concepts on decision-making in medicinal chemistry
2007 Standout
The evolving role of natural products in drug discovery
2005 Standout
Identification of topaquinone and its consensus sequence in copper amine oxidases
1992
Controlling morphology and porosity to improve performance of molecularly imprinted sol–gel silica
2013
Green Chemistry: Principles and Practice
2009 Standout
Pentafluorosulfanyl as a Novel Building Block for Enzyme Inhibitors: Trypanothione Reductase Inhibition and Antiprotozoal Activities of Diarylamines
2008
Structure-toxicity relationships for phenols to Tetrahymena pyriformis
1996
Synthetic Molecular Motors and Mechanical Machines
2006 Standout
How not to develop a quantitative structure–activity or structure–property relationship (QSAR/QSPR)
2009
ChEMBL: a large-scale bioactivity database for drug discovery
2011 Standout
Artificial neural networks for computer-based molecular design
1998
Computer-Assisted Design of New Drugs Based on Retrometabolic Concepts
1998
Descriptors for antimicrobial peptides
2011
Introduction of Fluorine and Fluorine‐Containing Functional Groups
2013 Standout
Bitter taste, phytonutrients, and the consumer: a review
2000 Standout
Designing antimicrobial peptides: form follows function
2011 Standout
Anchor extension: a structure-guided approach to design cyclic peptides targeting enzyme active sites
2021 StandoutNobel
Fractional description of free energies of solvation
1999
Chemoinformatics and Library Design
2010
How machine learning can help select capping layers to suppress perovskite degradation
2020 StandoutNobel
Cloning and Molecular Analysis of the Pea Seedling Copper Amine Oxidase
1995
Antibiotic activity of pentadecapeptides modelled from amino acid descriptors
2001
Detoxification of sulfur mustard by enzyme-catalyzed oxidation using chloroperoxidase
2013
Lead Optimization Using Matched Molecular Pairs: Inclusion of Contextual Information for Enhanced Prediction of hERG Inhibition, Solubility, and Lipophilicity
2010
Paul Ehrlich's magic bullet concept: 100 years of progress
2008 Standout
Supported gold nanoparticles as catalysts for organic reactions
2008 Standout
Discovery of practical production processes for arylsulfur pentafluorides and their higher homologues, bis- and tris(sulfur pentafluorides): Beginning of a new era of “super-trifluoromethyl” arene chemistry and its industry
2012
Sulfur(VI) Fluoride Exchange (SuFEx): Another Good Reaction for Click Chemistry
2014 StandoutNobel
Electrophilicity as a possible descriptor for toxicity prediction
2005
In silico prediction of drug toxicity
2003
Beyond Directing Groups: Transition‐Metal‐Catalyzed CH Activation of Simple Arenes
2012 Standout
Dendrimers and gold nanoparticles as exo-receptors sensing biologically important anions
2004
Photoremovable Protecting Groups in Chemistry and Biology: Reaction Mechanisms and Efficacy
2012 Standout
Stable Metal–Organic Frameworks: Design, Synthesis, and Applications
2018 Standout
Stereochemistry of copper amine oxidase reactions
1989
Selective Photooxidation of a Mustard‐Gas Simulant Catalyzed by a Porphyrinic Metal–Organic Framework
2015
Isolation and order of the cyanogen bromide fragments of concanavalin A
1971 StandoutNobel
Development and parametrization of continuum solvent models. II. A unified approach to the solvation problem
1996
Azole-Based Energetic Salts
2011 Standout
Deuterium Isotope Effects on Hydrophobic Interactions: The Importance of Dispersion Interactions in the Hydrophobic Phase
2003
A Hafnium-Based Metal–Organic Framework as a Nature-Inspired Tandem Reaction Catalyst
2015 StandoutNobel
Copper Active Sites in Biology
2014 Standout
Practical Aspects of Computational Chemistry
2009
Lectins: Cell-Agglutinating and Sugar-Specific Proteins
1972 StandoutScience
Improving Compound Activity Classification via Deep Transfer and Representation Learning
2022
Chem-Bioinformatics and QSAR: A Review of QSAR Lacking Positive Hydrophobic Terms
2001 Standout
Comparative QSAR: Toward a Deeper Understanding of Chemicobiological Interactions
1996
Quantitative approach to biochemical structure-activity relationships
1969
Hierarchically porous materials: synthesis strategies and structure design
2016 Standout
Pd-catalyzed ortho-arylation of phenylacetamides, benzamides, and anilides with simple arenes using sodium persulfate
2010
Molecular graphics and QSAR in the study of enzyme-ligand interactions. On the definition of bioreceptors
1986
Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics
1999 Standout
Synthetic chemistry and biological activity of pentafluorosulphanyl (SF5) organic molecules
2012
Use of gas chromatographic retention indices for quantitative structure activity relationship studies of dialkyl phenyl phosphates
1990
Conceptual Density Functional Theory
2003 Standout
A New Atom-Additive Method for Calculating Partition Coefficients
1997
The Nicotinic Pharmacophore: Thermodynamics of the Hydrogen-Bonding Complexation of Nicotine, Nornicotine, and Models
2003
Electrophilicity Index
2006 Standout
ProTox-II: a webserver for the prediction of toxicity of chemicals
2018 Standout
Selective Photooxidation of a Mustard‐Gas Simulant Catalyzed by a Porphyrinic Metal–Organic Framework
2015
Catalytic Dehydrogenative Cross-Coupling: Forming Carbon−Carbon Bonds by Oxidizing Two Carbon−Hydrogen Bonds
2011 Standout
Comparative QSAR: Radical Reactions of Benzene Derivatives in Chemistry and Biology
1997
Novel Perturbation Theory in Simple LCAO Treatment of Conjugated Molecules—Method of Perturbed Secular Determinant
1959 StandoutNobel
PubChem 2023 update
2022 Standout
Recent Progress on Ferroelectric Polymer-Based Nanocomposites for High Energy Density Capacitors: Synthesis, Dielectric Properties, and Future Aspects
2016 Standout
Preformed Antimicrobial Compounds and Plant Defense against Fungal Attack.
1996 Standout
Artificial Molecular Machines
2015 Standout
Electronic Structure and Auxin Activity of Benzoic Acid Derivatives
1958 StandoutNobel
Lipophilic Character and Biological Activity of Drugs II: The Parabolic Case
1973
Computational strategies for polymer dielectrics design
2014
An Electrophilicity Based Analysis of Toxicity of Aromatic Compounds Towards Tetrahymena Pyriformis
2005
Mechanisms Whereby Mononuclear Copper Proteins Functionalize Organic Substrates
1996 Standout
Scanning the Potential Energy Surface for Synthesis of Dendrimer-Wrapped Gold Clusters: Design Rules for True Single-Molecule Nanostructures
2012 StandoutNobel
Diverse Viewpoints on Computational Aspects of Molecular Diversity
2001
Photochemical Cleavage and Release of Para-Substituted Phenols from α-Keto Amides
2006
The pentafluorosulfanyl group in cannabinoid receptor ligands: synthesis and comparison with trifluoromethyl and tert-butyl analogues
2014
Multifunctional metal–organic framework catalysts: synergistic catalysis and tandem reactions
2016 Standout
Advances in Copper Complexes as Anticancer Agents
2013 Standout
The hydrophobic character of phenyl glycosides and its relation to the binding of saccharides to concanavalin A
1968
Quantitative Structure−Activity Relationships for thein VitroAntimycobacterial Activity of Pyrazinoic Acid Esters
1996
Glucosinolates and their breakdown products in food and food plants
1983 Standout
Electronic Structure and Nicotine-like Stimulant Activity in Choline Phenyl Ethers
1960 StandoutScienceNobel
Protein Radicals in Enzyme Catalysis
1998 Standout
QSAR Studies of Copper Azamacrocycles and Thiosemicarbazones: MM3 Parameter Development and Prediction of Biological Properties
2005
Quantum Mechanical Continuum Solvation Models
2005 Standout
Transport of benzenesulfonic acid derivatives through the rat erythrocyte membrane
1982
Dendrimers Designed for Functions: From Physical, Photophysical, and Supramolecular Properties to Applications in Sensing, Catalysis, Molecular Electronics, Photonics, and Nanomedicine
2010 Standout
Applications of Fluorine in Medicinal Chemistry
2015 Standout
QSAR Treatment of Electronic Substituent Effects Using Frontier Orbital Theory and Topological Parameters
2000
In silico toxicology: computational methods for the prediction of chemical toxicity
2016
Efficient and selective oxidation of sulfur mustard using singlet oxygen generated by a pyrene-based metal–organic framework
2016
Synopsis of Some Recent Tactical Application of Bioisosteres in Drug Design
2011 Standout
Universal model for the calculation of all organic solvent–water partition coefficients
1998
Postsynthetic Incorporation of a Singlet Oxygen Photosensitizer in a Metal–Organic Framework for Fast and Selective Oxidative Detoxification of Sulfur Mustard
2016 StandoutNobel
Molecular imprinting: perspectives and applications
2016 Standout
Works of Robert Muir being referenced
THE RELATIONSHIP OF STRUCTURE AND PLANT-GROWTH ACTIVITY OF SUBSTITUTED BENZOIC AND PHENOXYACETIC ACIDS
1951
Purification and Properties of Amine Oxidase from Epicotyls of Pisum sativum
1971
Soil biotransformation of thiodiglycol, the hydrolysis product of mustard gas: understanding the factors governing remediation of mustard gas contaminated soil
2012
On the Mechanism of Action of Growth Regulators
1953
Studies on Immunity
2010
Chemical Constitution as Related to Growth Regulator Action
1955
Correlation of Biological Activity of Phenoxyacetic Acids with Hammett Substituent Constants and Partition Coefficients
1962 Nature
The Correlation of Biological Activity of Plant Growth Regulators and Chloromycetin Derivatives with Hammett Constants and Partition Coefficients
1963
Gibberellin Induced Changes in Diffusible Auxins from Savoy Cabbage
1969
Auxin Activity of Glucobrassicin
1966
Structure-Activity Relationship in the Auxin Activity of Mono-Substituted Phenylacetic Acids
1967