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Top Articles

#TitleJournalYearCitations
1A new hybrid exchange–correlation functional using the Coulomb-attenuating method (CAM-B3LYP)Chemical Physics Letters200411,492
2Protein Misfolding, Functional Amyloid, and Human DiseaseAnnual Review of Biochemistry20065,737
3Emerging applications of stimuli-responsive polymer materialsNature Materials20105,007
4Protein folding and misfoldingNature20034,210
5Optimization of the Additive CHARMM All-Atom Protein Force Field Targeting Improved Sampling of the Backbone ϕ, ψ and Side-Chain χ1 and χ2 Dihedral AnglesJournal of Chemical Theory and Computation20123,696
6Accurate whole human genome sequencing using reversible terminator chemistryNature20083,118
7Structure of Graphite Oxide RevisitedJournal of Physical Chemistry B19983,026
8PLUMED 2: New feathers for an old birdComputer Physics Communications20142,454
9Modern Synthetic Methods for Copper-Mediated C(aryl)O, C(aryl)N, and C(aryl)S Bond FormationAngewandte Chemie - International Edition20032,412
10Inherent toxicity of aggregates implies a common mechanism for protein misfolding diseasesNature20022,322
11Mechanochemistry: opportunities for new and cleaner synthesisChemical Society Reviews20122,281
12Protein Misfolding, Amyloid Formation, and Human Disease: A Summary of Progress Over the Last DecadeAnnual Review of Biochemistry20171,929
13The amyloid state and its association with protein misfolding diseasesNature Reviews Molecular Cell Biology20141,894
14Challenges for Density Functional TheoryChemical Reviews20121,869
15An atomic multiconfigurational Dirac-Fock packageComputer Physics Communications19801,713
16Dynamic Combinatorial ChemistryChemical Reviews20061,707
17Efficient storage mechanisms for building better supercapacitorsNature Energy20161,655
18Modern Synthetic Methods for Copper-Mediated C(aryl)O, C(aryl)N, and C(aryl)S Bond FormationAngewandte Chemie - International Edition20041,653
19Evaluated kinetic and photochemical data for atmospheric chemistry: Volume I - gas phase reactions of O<sub>x</sub>, HO<sub>x</sub>, NO<sub>x</sub> and SO<sub>x</sub> speciesAtmospheric Chemistry and Physics20041,597
20Evaluated kinetic and photochemical data for atmospheric chemistry: Volume II – gas phase reactions of organic speciesAtmospheric Chemistry and Physics20061,508
21Recent developments in natural product synthesis using metal-catalysed C–H bond functionalisationChemical Society Reviews20111,508
22Left-right correlation energyMolecular Physics20011,487
23Cucurbituril-Based Molecular RecognitionChemical Reviews20151,467
24Polyketide biosynthesis: a millennium reviewNatural Product Reports20011,454
25Targeting G-quadruplexes in gene promoters: a novel anticancer strategy?Nature Reviews Drug Discovery20111,447
26Protein aggregation and aggregate toxicity: new insights into protein folding, misfolding diseases and biological evolutionJournal of Molecular Medicine20031,444
27Single-molecule strong coupling at room temperature in plasmonic nanocavitiesNature20161,391
28Development and assessment of new exchange-correlation functionalsJournal of Chemical Physics19981,374
29Mechanism of auxin perception by the TIR1 ubiquitin ligaseNature20071,367
30Extracellular-matrix tethering regulates stem-cell fateNature Materials20121,346
31Polymer brushes via surface-initiated polymerizationsChemical Society Reviews20041,274
32Selective oxidation with dioxygen by gold nanoparticle catalysts derived from 55-atom clustersNature20081,242
33Systemic insecticides (neonicotinoids and fipronil): trends, uses, mode of action and metabolitesEnvironmental Science and Pollution Research20151,215
34Evaluated Kinetic Data for Combustion Modeling: Supplement IIJournal of Physical and Chemical Reference Data20051,189
35Proliferation of amyloid-β42 aggregates occurs through a secondary nucleation mechanismProceedings of the National Academy of Sciences of the United States of America20131,162
36Rationalization of the effects of mutations on peptide andprotein aggregation ratesNature20031,013
37White Phosphorus Is Air-Stable Within a Self-Assembled Tetrahedral CapsuleScience2009995
38Supramolecular polymeric hydrogelsChemical Society Reviews2012988
39Ion mobility–mass spectrometry analysis of large protein complexesNature Protocols2008973
40An Analytical Solution to the Kinetics of Breakable Filament AssemblyScience2009970
41High-throughput sequencing of DNA G-quadruplex structures in the human genomeNature Biotechnology2015954
42Tropospheric ozone and its precursors from the urban to the global scale from air quality to short-lived climate forcerAtmospheric Chemistry and Physics2015942
43The rapid evolution of highly efficient perovskite solar cellsEnergy and Environmental Science2017942
44Sustainability and in situ monitoring in battery developmentNature Materials2017930
45A Meta-Selective Copper-Catalyzed C–H Bond ArylationScience2009915
46Fluorescent chemosensors for Zn2+Chemical Society Reviews2010910
47Evaluated Kinetic, Photochemical and Heterogeneous Data for Atmospheric Chemistry: Supplement V.   IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric ChemistryJournal of Physical and Chemical Reference Data1997903
48Microdroplets in Microfluidics: An Evolving Platform for Discoveries in Chemistry and BiologyAngewandte Chemie - International Edition2010903
49Environmental fate and exposure; neonicotinoids and fipronilEnvironmental Science and Pollution Research2015903
50Improving virtual Kohn–Sham orbitals and eigenvalues: Application to excitation energies and static polarizabilitiesJournal of Chemical Physics1998886