6.3K(top 0.1%)
papers
431.1K(top 0.1%)
citations
245(top 0.1%)
h-index
523(top 0.1%)
g-index
8.2K
all documents
491.2K
doc citations
10.4K
citing journals

Top Articles

#TitleJournalYearCitations
1UCSF Chimera—A visualization system for exploratory research and analysisJournal of Computational Chemistry200438,977
2Features and development of CootActa Crystallographica Section D: Biological Crystallography201024,068
3Long-range corrected hybrid density functionals with damped atom–atom dispersion correctionsPhysical Chemistry Chemical Physics200811,057
4Room-Temperature Ultraviolet Nanowire NanolasersScience20018,606
5Quantum Dots for Live Cells, in Vivo Imaging, and DiagnosticsScience20057,435
6Rhodium-Catalyzed C−C Bond Formation via Heteroatom-Directed C−H Bond ActivationChemical Reviews20103,524
7Systematic optimization of long-range corrected hybrid density functionalsJournal of Chemical Physics20083,030
8Bioorthogonal Chemistry: Fishing for Selectivity in a Sea of FunctionalityAngewandte Chemie - International Edition20092,679
9A Strain-Promoted [3 + 2] Azide−Alkyne Cycloaddition for Covalent Modification of Biomolecules in Living SystemsJournal of the American Chemical Society20042,379
10Single-Reference ab Initio Methods for the Calculation of Excited States of Large MoleculesChemical Reviews20052,370
11Nanowire Ultraviolet Photodetectors and Optical SwitchesAdvanced Materials20022,147
12TRANSITIONPATHSAMPLING: Throwing Ropes Over Rough Mountain Passes, in the DarkAnnual Review of Physical Chemistry20021,745
13Mesoporous silica nanoparticles in biomedical applicationsChemical Society Reviews20121,694
14Assigning protein functions by comparative genome analysis: Protein phylogenetic profilesProceedings of the National Academy of Sciences of the United States of America19991,674
15A novel discrete variable representation for quantum mechanical reactive scattering via the S‐matrix Kohn methodJournal of Chemical Physics19921,603
16A molecular ruler based on plasmon coupling of single gold and silver nanoparticlesNature Biotechnology20051,447
17Charge separation and transport in conjugated-polymer/semiconductor-nanocrystal composites studied by photoluminescence quenching and photoconductivityPhysical Review B19961,430
18Atherosclerosis: Basic MechanismsCirculation19951,395
19Thermally stable Pt/mesoporous silica core–shell nanocatalysts for high-temperature reactionsNature Materials20091,393
20Controlled growth of tetrapod-branched inorganic nanocrystalsNature Materials20031,382
21NEONICOTINOID INSECTICIDE TOXICOLOGY: Mechanisms of Selective ActionAnnual Review of Pharmacology and Toxicology20051,347
22Perspective on density functional theoryJournal of Chemical Physics20121,302
23Virtual screening of chemical librariesNature20041,202
24Molecular mechanistic origin of the toughness of natural adhesives, fibres and compositesNature19991,167
25Electromagnetic theories of surface-enhanced Raman spectroscopyChemical Society Reviews20171,111
26Efficiency and Fidelity in a Click-Chemistry Route to Triazole Dendrimers by the Copper(I)-Catalyzed Ligation of Azides and AlkynesAngewandte Chemie - International Edition20041,094
27Highly efficient separation of carbon dioxide by a metal-organic framework replete with open metal sitesProceedings of the National Academy of Sciences of the United States of America20091,055
28Total synthesis of taxolNature19941,048
29Graphene-based materials for flexible supercapacitorsChemical Society Reviews20151,046
30RCSB Protein Data Bank: powerful new tools for exploring 3D structures of biological macromolecules for basic and applied research and education in fundamental biology, biomedicine, biotechnology, bioengineering and energy sciencesNucleic Acids Research20211,036
31Synthetic fluorescent sensors for studying the cell biology of metalsNature Chemical Biology20081,027
32Hydrocarbon Hydroxylation by Cytochrome P450 EnzymesChemical Reviews20101,007
33π-Bonding and the Lone Pair Effect in Multiple Bonds Involving Heavier Main Group Elements: Developments in the New MillenniumChemical Reviews20101,006
34Two-dimensional transition metal dichalcogenides as atomically thin semiconductors: opportunities and challengesChemical Society Reviews2015958
35Direct Functionalization of Nitrogen Heterocycles via Rh-Catalyzed C−H Bond ActivationAccounts of Chemical Research2008936
36Towards establishing standard performance metrics for batteries, supercapacitors and beyondChemical Society Reviews2019910
37H‐TiO2@MnO2//H‐TiO2@C Core–Shell Nanowires for High Performance and Flexible Asymmetric SupercapacitorsAdvanced Materials2013900
38A mechanism for hormone-independent prostate cancer through modulation of androgen receptor signaling by the HER-2/neu tyrosine kinaseNature Medicine1999894
39Light-Emitting PolythiophenesAdvanced Materials2005866
40Synthesis, Characterization, and Theory of [9]-, [12]-, and [18]Cycloparaphenylene: Carbon Nanohoop StructuresJournal of the American Chemical Society2008849
41Suberoylanilide hydroxamic acid, a histone deacetylase inhibitor, ameliorates motor deficits in a mouse model of Huntington's diseaseProceedings of the National Academy of Sciences of the United States of America2003809
42Yb14MnSb11:  New High Efficiency Thermoelectric Material for Power GenerationChemistry of Materials2006806
43mtDNA mutations increase tumorigenicity in prostate cancerProceedings of the National Academy of Sciences of the United States of America2005774
44“STRONG” HYDROGEN BONDS IN CHEMISTRY AND BIOLOGYAnnual Review of Physical Chemistry1997759
45Birth of the D-E-A-D boxNature1989751
463D domain swapping: A mechanism for oligomer assemblyProtein Science1995747
47Electrospinning of Continuous Carbon Nanotube-Filled Nanofiber YarnsAdvanced Materials2003720
48Semiconductor Nanowire: What’s Next?Nano Letters2010720
49Exciton diffusion in organic semiconductorsEnergy and Environmental Science2015720
50Electrochemical Water Oxidation with Cobalt-Based Electrocatalysts from pH 0–14: The Thermodynamic Basis for Catalyst Structure, Stability, and ActivityJournal of the American Chemical Society2011705