There are lots of different ways to look at the reach of an article. You can look at citations, Altmetric Attention Scores, awards, and more. One way to consider the influence of an article is just by looking at how many people chose to read it. To that end, we’ve compiled lists of the five most-read chemistry articles that appeared in each ACS Publications journal in April 2018, including research, reviews, perspectives and editorial pieces. These lists were not chosen by the journal’s editors and should not be taken as a “best of” list, but as another perspective on where the chemistry community allocated their attention.
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Read more of April’s most-read articles: Analytical | Biological | Materials Science & Engineering | Multidisciplinary | Organic/Inorganic | Physical
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ACS Applied Materials & Interfaces
Smooth, All-Solid, Low-Hysteresis, Omniphobic Surfaces with Enhanced Mechanical Durability
ACS Appl. Mater. Interfaces, 2018, 10 (14), pp 11406–11413
DOI: 10.1021/acsami.8b00521
Ancient Chemistry “Pharaoh’s Snakes” for Efficient Fe-/N-Doped Carbon Electrocatalysts
Open access through ACS Editors’ Choice
ACS Appl. Mater. Interfaces, 2018, 10 (13), pp 10778–10785
DOI: 10.1021/acsami.7b16936
Zeolite-like Metal–Organic Framework (MOF) Encaged Pt(II)-Porphyrin for Anion-Selective Sensing
ACS Appl. Mater. Interfaces, 2018, 10 (14), pp 11399–11405
DOI: 10.1021/acsami.7b19282
One-Pot Fabrication of Antireflective/Antibacterial Dual-Function Ag NP-Containing Mesoporous Silica Thin Films
ACS Appl. Mater. Interfaces, 2018, 10 (13), pp 11189–11196
DOI: 10.1021/acsami.8b00192
Aggregation-Induced Emission Probe for Study of the Bactericidal Mechanism of Antimicrobial Peptides
ACS Appl. Mater. Interfaces, 2018, 10 (14), pp 11436–11442
DOI: 10.1021/acsami.7b18221
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ACS Applied Energy Materials
Promoting Charge Separation in g-C3N4/Graphene/MoS2 Photocatalysts by Two-Dimensional Nanojunction for Enhanced Photocatalytic H2 Production
ACS Appl. Energy Mater., 2018, 1 (4), pp 1400–1407
DOI: 10.1021/acsaem.8b00030
Plastic Metal-Free Electric Motor by 3D Printing of Graphene-Polyamide Powder
ACS Appl. Energy Mater., 2018, 1 (4), pp 1726–1733
DOI: 10.1021/acsaem.8b00240
Self-Healing Liquid Metal and Si Composite as a High-Performance Anode for Lithium-Ion Batteries
ACS Appl. Energy Mater., 2018, 1 (4), pp 1395–1399
DOI: 10.1021/acsaem.8b00022
Free-Standing Nitrogen-Doped Cup-Stacked Carbon Nanotube Mats for Potassium-Ion Battery Anodes
ACS Appl. Energy Mater., 2018, 1 (4), pp 1703–1707
DOI: 10.1021/acsaem.8b00182
Artificial Solid Electrolyte Interphase Layer for Lithium Metal Anode in High-Energy Lithium Secondary Pouch Cells
ACS Appl. Energy Mater., 2018, 1 (4), pp 1674–1679
DOI: 10.1021/acsaem.8b00132
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ACS Applied Nano Materials
One-Pot Green Synthesis of Fe3O4/MoS2 0D/2D Nanocomposites and Their Application in Noninvasive Point-of-Care Glucose Diagnostics
ACS Appl. Nano Mater., 2018, 1 (4), pp 1949–1958
DOI: 10.1021/acsanm.8b00429
Strain Modulated Electronic, Mechanical, and Optical Properties of the Monolayer PdS2, PdSe2, and PtSe2 for Tunable Devices
ACS Appl. Nano Mater., 2018, 1 (4), pp 1932–1939
DOI: 10.1021/acsanm.8b00363
Hierarchical PbZrxTi1–xO3 Nanowires for Vibrational Energy Harvesting
ACS Appl. Nano Mater., 2018, 1 (4), pp 1461–1466
DOI: 10.1021/acsanm.7b00317
Visible-Light-Triggered Reactive-Oxygen-Species-Mediated Antibacterial Activity of Peroxidase-Mimic CuO Nanorods
ACS Appl. Nano Mater., 2018, 1 (4), pp 1694–1704
DOI: 10.1021/acsanm.8b00153
Biogenic Synthesis of Pd-Based Nanoparticles with Enhanced Catalytic Activity
ACS Appl. Nano Mater., 2018, 1 (4), pp 1467–1475
DOI: 10.1021/acsanm.7b00322
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ACS Biomaterials Science & Engineering
Regenerative Biomaterials
This article is part of the Regenerative Biomaterials special issue.
ACS Biomater. Sci. Eng., 2018, 4 (4), pp 1113–1114
DOI: 10.1021/acsbiomaterials.8b00358
Materials-Directed Differentiation of Mesenchymal Stem Cells for Tissue Engineering and Regeneration
This article is part of the Regenerative Biomaterials special issue.
ACS Biomater. Sci. Eng., 2018, 4 (4), pp 1115–1127
DOI: 10.1021/acsbiomaterials.6b00741
Raman Spectroscopy for Advanced Polymeric Biomaterials
ACS Biomater. Sci. Eng., 2018, 4 (4), pp 1285–1299
DOI: 10.1021/acsbiomaterials.8b00258
Biodegradable Water-Based Polyurethane Shape Memory Elastomers for Bone Tissue Engineering
ACS Biomater. Sci. Eng., 2018, 4 (4), pp 1397–1406
DOI: 10.1021/acsbiomaterials.8b00091
Multidomain Peptide Hydrogel Accelerates Healing of Full-Thickness Wounds in Diabetic Mice
ACS Biomater. Sci. Eng., 2018, 4 (4), pp 1386–1396
DOI: 10.1021/acsbiomaterials.8b00031
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ACS Combinatorial Science
Synthesis of Highly Substituted Imidazole Uracil Containing Molecules via Ugi-4CR and Passerini-3CR
Open access through ACS AuthorChoice
ACS Comb. Sci., 2018, 20 (4), pp 192–196
DOI: 10.1021/acscombsci.7b00145
Comparison of Cell Permeability of Cyclic Peptoids and Linear Peptoids
ACS Comb. Sci., 2018, 20 (4), pp 237–242
DOI: 10.1021/acscombsci.7b00194
Solid-Phase Synthesis of Pyrrole Derivatives through a Multicomponent Reaction Involving Lys-Containing Peptides
ACS Comb. Sci., 2018, 20 (4), pp 187–191
DOI: 10.1021/acscombsci.8b00006
A General Small-Angle X-ray Scattering-Based Screening Protocol Validated for Protein–RNA Interactions
Open access through ACS AuthorChoice
ACS Comb. Sci., 2018, 20 (4), pp 197–202
DOI: 10.1021/acscombsci.8b00007
Synthesis of Cyclic Peptides as Potential Anti-Malarials
ACS Comb. Sci., 2018, 20 (4), pp 212–219
DOI: 10.1021/acscombsci.7b00154
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ACS Energy Letters
Plasma Technology: An Emerging Technology for Energy Storage
Open access through ACS Editors’ Choice
ACS Energy Lett., 2018, 3 (4), pp 1013–1027
DOI: 10.1021/acsenergylett.8b00184
Impedance Spectroscopy Measurements in Perovskite Solar Cells: Device Stability and Noise Reduction
ACS Energy Lett., 2018, 3 (4), pp 1044–1048
DOI: 10.1021/acsenergylett.8b00465
Interstitial Mn2+-Driven High-Aspect-Ratio Grain Growth for Low-Trap-Density Microcrystalline Films for Record Efficiency CsPbI2Br Solar Cells
ACS Energy Lett., 2018, 3 (4), pp 970–978
DOI: 10.1021/acsenergylett.8b00270
Perovskite Solar Cells in the Public Domain as the Community Gears Up for Technical Advances
ACS Energy Lett., 2018, 3 (4), pp 890–891
DOI: 10.1021/acsenergylett.8b00403
Bifunctional 2D Superlattice Electrocatalysts of Layered Double Hydroxide–Transition Metal Dichalcogenide Active for Overall Water Splitting
ACS Energy Lett., 2018, 3 (4), pp 952–960
DOI: 10.1021/acsenergylett.8b00134
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ACS Infectious Diseases
Fragment-Based Screening of a Natural Product Library against 62 Potential Malaria Drug Targets Employing Native Mass Spectrometry
Open access through ACS Editors’ Choice
ACS Infect. Dis., 2018, 4 (4), pp 431–444
DOI: 10.1021/acsinfecdis.7b00197
Targeting the Proteostasis Network for Mycobacterial Drug Discovery
Open access through ACS AuthorChoice
ACS Infect. Dis., 2018, 4 (4), pp 478–498
DOI: 10.1021/acsinfecdis.7b00231
2nd SCI/RSC Symposium on Medicinal Chemistry for Global Health: A Unique Opportunity for the Field
ACS Infect. Dis., 2018, 4 (4), pp 424–428
DOI: 10.1021/acsinfecdis.8b00022
Genetically Validated Drug Targets in Leishmania: Current Knowledge and Future Prospects
Open access through ACS AuthorChoice
ACS Infect. Dis., 2018, 4 (4), pp 467–477
DOI: 10.1021/acsinfecdis.7b00244
Special Issue on Drug Discovery for Global Health
This article is part of the Drug Discovery for Global Health special issue.
ACS Infect. Dis., 2018, 4 (4), pp 429–430
DOI: 10.1021/acsinfecdis.8b00055
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ACS Medicinal Chemistry Letters
Discovery of AG-120 (Ivosidenib): A First-in-Class Mutant IDH1 Inhibitor for the Treatment of IDH1 Mutant Cancers
Open access through ACS AuthorChoice
ACS Med. Chem. Lett., 2018, 9 (4), pp 300–305
DOI: 10.1021/acsmedchemlett.7b00421
Discovery of Novel Indoleamine 2,3-Dioxygenase 1 (IDO1) and Histone Deacetylase (HDAC) Dual Inhibitors
ACS Med. Chem. Lett., 2018, 9 (4), pp 312–317
DOI: 10.1021/acsmedchemlett.7b00487
Azabicyclic Fused Pyrimidine Derivatives Useful for the Treatment of Alzheimer’s Disease
ACS Med. Chem. Lett., 2018, 9 (4), pp 290–291
DOI: 10.1021/acsmedchemlett.8b00086
Modulating ADME Properties by Fluorination: MK2 Inhibitors with Improved Oral Exposure
ACS Med. Chem. Lett., 2018, 9 (4), pp 392–396
DOI: 10.1021/acsmedchemlett.8b00098
ATR Inhibitors as Potential Treatment for Cancers
ACS Med. Chem. Lett., 2018, 9 (4), pp 292–293
DOI: 10.1021/acsmedchemlett.8b00107
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ACS Sensors
What Are the Basic Elements of a Novel Sensor Paper?
ACS Sens., 2018, 3 (4), pp 742–742
DOI: 10.1021/acssensors.8b00275
Optofluidic Sensor for Inline Hemolysis Detection on Whole Blood
Open access through ACS AuthorChoice
ACS Sens., 2018, 3 (4), pp 784–791
DOI: 10.1021/acssensors.8b00030
Ratiometric Fluorescent Biosensor for Visual Discrimination of Cancer Cells with Different Telomerase Expression Levels
ACS Sens., 2018, 3 (4), pp 757–762
DOI: 10.1021/acssensors.8b00059
Determination of Gold Ions in Human Urine Using Genetically Engineered Microorganisms on a Paper Device
ACS Sens., 2018, 3 (4), pp 744–748
DOI: 10.1021/acssensors.7b00931
Selective Determination of Cr(VI) by Glutaraldehyde Cross-Linked Chitosan Polymer Fluorophores
ACS Sens., 2018, 3 (4), pp 792–798
DOI: 10.1021/acssensors.8b00038
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ACS Sustainable Chemistry & Engineering
Converting Waste Papers to Fluorescent Carbon Dots in the Recycling Process without Loss of Ionic Liquids and Bioimaging Applications
Open access through ACS Editors’ Choice
ACS Sustainable Chem. Eng., 2018, 6 (4), pp 4510–4515
DOI: 10.1021/acssuschemeng.8b00353
ACS Sustainable Chemistry & Engineering Virtual Special Issue on Promoting the Development and Use of Quantitative Sustainabilty Metrics
ACS Sustainable Chem. Eng., 2018, 6 (4), pp 4422–4422
DOI: 10.1021/acssuschemeng.8b01268
The Road to Biorenewables: Carbohydrates to Commodity Chemicals
ACS Sustainable Chem. Eng., 2018, 6 (4), pp 4464–4480
DOI: 10.1021/acssuschemeng.8b00376
Hierarchical CoTe2 Nanowire Array: An Effective Oxygen Evolution Catalyst in Alkaline Media
ACS Sustainable Chem. Eng., 2018, 6 (4), pp 4481–4485
DOI: 10.1021/acssuschemeng.7b04309
P-Doped Ag Nanoparticles Embedded in N-Doped Carbon Nanoflake: An Efficient Electrocatalyst for the Hydrogen Evolution Reaction
ACS Sustainable Chem. Eng., 2018, 6 (4), pp 4499–4503
DOI: 10.1021/acssuschemeng.7b04732
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ACS Synthetic Biology
Remote Control of Mammalian Cells with Heat-Triggered Gene Switches and Photothermal Pulse Trains
ACS Synth. Biol., 2018, 7 (4), pp 1167–1173
DOI: 10.1021/acssynbio.7b00455
Rational Design of Mini-Cas9 for Transcriptional Activation
ACS Synth. Biol., 2018, 7 (4), pp 978–985
DOI: 10.1021/acssynbio.7b00404
MIDAS: A Modular DNA Assembly System for Synthetic Biology
ACS Synth. Biol., 2018, 7 (4), pp 1018–1029
DOI: 10.1021/acssynbio.7b00363
Cameo: A Python Library for Computer Aided Metabolic Engineering and Optimization of Cell Factories
Open access through ACS AuthorChoice
ACS Synth. Biol., 2018, 7 (4), pp 1163–1166
DOI: 10.1021/acssynbio.7b00423
T7 Polymerase Expression of Guide RNAs in vivo Allows Exportable CRISPR-Cas9 Editing in Multiple Yeast Hosts
ACS Synth. Biol., 2018, 7 (4), pp 1075–1084
DOI: 10.1021/acssynbio.7b00461
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Analytical Chemistry
Sniffing Entrapped Humans with Sensor Arrays
Open access through ACS AuthorChoice
Anal. Chem., 2018, 90 (8), pp 4940–4945
DOI: 10.1021/acs.analchem.8b00237
Lipidomic Analysis
Anal. Chem., 2018, 90 (7), pp 4249–4257
DOI: 10.1021/acs.analchem.7b05395
Highly Sensitive Electrochemical Detection of Tumor Exosomes Based on Aptamer Recognition-Induced Multi-DNA Release and Cyclic Enzymatic Amplification
Anal. Chem., 2018, 90 (7), pp 4507–4513
DOI: 10.1021/acs.analchem.7b04863
Using Bioluminescence Turn-On To Detect Cysteine in Vitro and in Vivo
Anal. Chem., 2018, 90 (8), pp 4951–4954
DOI: 10.1021/acs.analchem.8b00682
Cascade Amplification-Mediated In Situ Hot-Spot Assembly for MicroRNA Detection and Molecular Logic Gate Operations
Anal. Chem., 2018, 90 (7), pp 4544–4551
DOI: 10.1021/acs.analchem.7b04930
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Chemical Research in Toxicology
The Double-Edged Sword Profile of Redox Signaling: Oxidative Events As Molecular Switches in the Balance between Cell Physiology and Cancer
Chem. Res. Toxicol., 2018, 31 (4), pp 201–210
DOI: 10.1021/acs.chemrestox.7b00311
Thiol Reactivity of Curcumin and Its Oxidation Products
Chem. Res. Toxicol., 2018, 31 (4), pp 269–276
DOI: 10.1021/acs.chemrestox.7b00326
Free Radical Production and Oxidative Stress in Lung Tissue of Patients Exposed to Sulfur Mustard: An Overview of Cellular and Molecular Mechanisms
Chem. Res. Toxicol., 2018, 31 (4), pp 211–222
DOI: 10.1021/acs.chemrestox.7b00315
Role of Glucuronidation and P450 Oxidation in the Bioactivation of Bromfenac
Chem. Res. Toxicol., 2018, 31 (4), pp 223–230
DOI: 10.1021/acs.chemrestox.7b00293
β-Cyclodextrin Reverses Binding of Perfluorooctanoic Acid to Human Serum Albumin
Chem. Res. Toxicol., 2018, 31 (4), pp 277–284
DOI: 10.1021/acs.chemrestox.8b00002
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Crystal Growth & Design
Predicting the Kinetics of Ice Recrystallization in Aqueous Sugar Solutions
Open access through ACS AuthorChoice
Cryst. Growth Des., 2018, 18 (4), pp 2405–2416
DOI: 10.1021/acs.cgd.8b00038
Exceptionally Stable and 20-Connected Lanthanide Metal–Organic Frameworks for Selective CO2 Capture and Conversion at Atmospheric Pressure
Cryst. Growth Des., 2018, 18 (4), pp 2432–2440
DOI: 10.1021/acs.cgd.8b00065
Recent Advances in Halide-Based Perovskite Crystals and Their Optoelectronic Applications
Cryst. Growth Des., 2018, 18 (4), pp 2645–2664
DOI: 10.1021/acs.cgd.7b01767
Polycatenated 2D Hydrogen-Bonded Binary Supramolecular Organic Frameworks (SOFs) with Enhanced Gas Adsorption and Selectivity
Cryst. Growth Des., 2018, 18 (4), pp 2555–2562
DOI: 10.1021/acs.cgd.8b00153
External Pressure Effect on a Twofold Interpenetrated 3D PtS-Type Spin-Crossover Coordination Polymer
Cryst. Growth Des., 2018, 18 (4), pp 1931–1934
DOI: 10.1021/acs.cgd.7b01701
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Energy & Fuels
6th Sino-Australian Symposium on Advanced Coal and Biomass Utilisation Technologies
This article is part of the 6th Sino-Australian Symposium on Advanced Coal and Biomass Utilisation Technologies special issue.
Energy Fuels, 2018, 32 (4), pp 4065–4068
DOI: 10.1021/acs.energyfuels.8b00914
Metals and Other Elements in Biocrude from Fast and Isothermal Hydrothermal Liquefaction of Microalgae
Open access through ACS AuthorChoice
Energy Fuels, 2018, 32 (4), pp 4118–4126
DOI: 10.1021/acs.energyfuels.7b03144
Effect of Pressure on Ethane Dehydrogenation in MFI Zeolite Membrane Reactor
Energy Fuels, 2018, 32 (4), pp 4628–4637
DOI: 10.1021/acs.energyfuels.7b03442
Distinctive Hydrodynamics of a Micro Fluidized Bed and Its Application to Gas–Solid Reaction Analysis
Energy Fuels, 2018, 32 (4), pp 4096–4106
DOI: 10.1021/acs.energyfuels.7b03003
Compositional Effect of Gasoline on Fuel Economy and Emissions
Energy Fuels, 2018, 32 (4), pp 5072–5080
DOI: 10.1021/acs.energyfuels.8b00722
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Environmental Science & Technology
ES&T’s Best Papers of 2017
Environ. Sci. Technol., 2018, 52 (7), pp 3833–3834
DOI: 10.1021/acs.est.8b01615
What is the Best Biological Process for Nitrogen Removal: When and Why?
Environ. Sci. Technol., 2018, 52 (7), pp 3835–3841
DOI: 10.1021/acs.est.7b05832
Omics Advances in Ecotoxicology
Environ. Sci. Technol., 2018, 52 (7), pp 3842–3851
DOI: 10.1021/acs.est.7b06494
Detection and Quantification of Graphene-Family Nanomaterials in the Environment
Environ. Sci. Technol., 2018, 52 (8), pp 4491–4513
DOI: 10.1021/acs.est.7b04938
Porous Electrospun Fibers Embedding TiO2 for Adsorption and Photocatalytic Degradation of Water Pollutants
Environ. Sci. Technol., 2018, 52 (7), pp 4285–4293
DOI: 10.1021/acs.est.7b06508
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Environmental Science & Technology Letters
Awards for the Best Papers in ES&T Letters in 2017!
Environ. Sci. Technol. Lett., 2018, 5 (4), pp 194–195
DOI: 10.1021/acs.estlett.8b00158
Biomagnification of Tantalum through Diverse Aquatic Food Webs
Environ. Sci. Technol. Lett., 2018, 5 (4), pp 196–201
DOI: 10.1021/acs.estlett.8b00051
Imaging Organic–Mineral Aggregates Formed by Fe(II)-Oxidizing Bacteria Using Helium Ion Microscopy
Environ. Sci. Technol. Lett., 2018, 5 (4), pp 209–213
DOI: 10.1021/acs.estlett.8b00077
Mechanisms of Methyl Mercury Net Degradation in Alder Swamps: The Role of Methanogens and Abiotic Processes
Environ. Sci. Technol. Lett., 2018, 5 (4), pp 220–225
DOI: 10.1021/acs.estlett.8b00081
δ13C and δ37Cl Isotope Fractionation To Characterize Aerobic vs Anaerobic Degradation of Trichloroethylene
Environ. Sci. Technol. Lett., 2018, 5 (4), pp 202–208
DOI: Capture and Purification of Polyphenols Using Functionalized Hydrophobic Resins
Open access through ACS Editors’ Choice
Ind. Eng. Chem. Res., 2018, 57 (15), pp 5359–5369
DOI: 10.1021/acs.iecr.7b0507110.1021/acs.estlett.8b00100
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Industrial & Engineering Chemistry Research
Conversion of Biomass and Its Derivatives to Levulinic Acid and Levulinate Esters via Ionic Liquids
Ind. Eng. Chem. Res., 2018, 57 (14), pp 4749–4766
DOI: 10.1021/acs.iecr.8b00273
Capture and Purification of Polyphenols Using Functionalized Hydrophobic Resins
Open access through ACS Editors’ Choice
Ind. Eng. Chem. Res., 2018, 57 (15), pp 5359–5369
DOI: 10.1021/acs.iecr.7b05071
Double-Confined Sulfur Inside Compressed Nickel Foam and Pencil-Plating Graphite for Lithium–Sulfur Battery
Ind. Eng. Chem. Res., 2018, 57 (14), pp 4880–4886
DOI: 10.1021/acs.iecr.7b04338
Methane Adsorption and Separation in Slipped and Functionalized Covalent Organic Frameworks
Ind. Eng. Chem. Res., 2018, 57 (14), pp 4767–4778
DOI: 10.1021/acs.iecr.7b05031
Controllable Synthesis of Styrene-divinylbenzene Adsorption Resins and the Effect of Textural Properties on Removal Performance of Fermentation Inhibitors from Rice Straw Hydrolysate
Ind. Eng. Chem. Res., 2018, 57 (14), pp 5119–5127
DOI: 10.1021/acs.iecr.8b00545
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Journal of Agricultural and Food Chemistry
Food Design To Feed the Human Gut Microbiota
Open access through ACS AuthorChoice
J. Agric. Food Chem., 2018, 66 (15), pp 3754–3758
DOI: 10.1021/acs.jafc.8b00456
Coencapsulation of (−)-Epigallocatechin-3-gallate and Quercetin in Particle-Stabilized W/O/W Emulsion Gels: Controlled Release and Bioaccessibility
J. Agric. Food Chem., 2018, 66 (14), pp 3691–3699
DOI: 10.1021/acs.jafc.7b05161
Polyphenols’ Gut Microbiota Metabolites: Bioactives or Biomarkers?
J. Agric. Food Chem., 2018, 66 (14), pp 3593–3594
DOI: 10.1021/acs.jafc.8b00827
What Do We Know about the Chemistry of Strawberry Aroma?
J. Agric. Food Chem., 2018, 66 (13), pp 3291–3301
DOI: 10.1021/acs.jafc.8b01115
Effective Enrichment and Detection of Trace Polycyclic Aromatic Hydrocarbons in Food Samples based on Magnetic Covalent Organic Framework Hybrid Microspheres
J. Agric. Food Chem., 2018, 66 (13), pp 3572–3580
DOI: 10.1021/acs.jafc.8b00869
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Journal of Chemical & Engineering Data
Festschrift Honoring Cor J. Peters
This article is part of the In Honor of Cor Peters special issue.
J. Chem. Eng. Data, 2018, 63 (4), pp 859–859
DOI: 10.1021/acs.jced.8b00149
Solubility of Solids in Sub- and Supercritical Fluids: A Review 2010–2017
This article is part of the In Honor of Cor Peters special issue.
J. Chem. Eng. Data, 2018, 63 (4), pp 860–884
DOI: 10.1021/acs.jced.7b00778
Molecular Simulation of Vapor–Liquid Equilibria Using the Wolf Method for Electrostatic Interactions
Open access through ACS AuthorChoice
J. Chem. Eng. Data, 2018, 63 (4), pp 1096–1102
DOI: 10.1021/acs.jced.7b00839
Modified Trouton’s Rule for the Estimation, Correlation, and Evaluation of Pure-Component Vapor Pressure
This article is part of the In Honor of Cor Peters special issue.
J. Chem. Eng. Data, 2018, 63 (4), pp 943–953
DOI: 10.1021/acs.jced.7b00767
Carbon Dioxide Solubilities in Decanoic Acid-Based Hydrophobic Deep Eutectic Solvents
This article is part of the In Honor of Cor Peters special issue.
J. Chem. Eng. Data, 2018, 63 (4), pp 913–919
DOI: 10.1021/acs.jced.7b00534
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Journal of Chemical Information and Modeling
ReFlex3D: Refined Flexible Alignment of Molecules Using Shape and Electrostatics
J. Chem. Inf. Model., 2018, 58 (4), pp 747–760
DOI: 10.1021/acs.jcim.7b00618
Large-Scale Validation of Mixed-Solvent Simulations to Assess Hotspots at Protein–Protein Interaction Interfaces
J. Chem. Inf. Model., 2018, 58 (4), pp 784–793
DOI: 10.1021/acs.jcim.7b00487
Discovery of Novel Adenosine Receptor Antagonists through a Combined Structure- and Ligand-Based Approach Followed by Molecular Dynamics Investigation of Ligand Binding Mode
J. Chem. Inf. Model., 2018, 58 (4), pp 794–815
DOI: 10.1021/acs.jcim.7b00455
Simulation-Guided Design of Cytochrome P450 for Chemo- and Regioselective Macrocyclic Oxidation
J. Chem. Inf. Model., 2018, 58 (4), pp 848–858
DOI: 10.1021/acs.jcim.8b00043
Virtual Screening of Novel and Selective Inhibitors of Protein Tyrosine Phosphatase 1B over T-Cell Protein Tyrosine Phosphatase Using a Bidentate Inhibition Strategy
J. Chem. Inf. Model., 2018, 58 (4), pp 837–847
DOI: 10.1021/acs.jcim.8b00040
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Journal of Chemical Theory and Computation
How Accurate Is Density Functional Theory at Predicting Dipole Moments? An Assessment Using a New Database of 200 Benchmark Values
J. Chem. Theory Comput., 2018, 14 (4), pp 1969–1981
DOI: 10.1021/acs.jctc.7b01252
Transferable Neural Networks for Enhanced Sampling of Protein Dynamics
J. Chem. Theory Comput., 2018, 14 (4), pp 1887–1894
DOI: 10.1021/acs.jctc.8b00025
SLTCAP: A Simple Method for Calculating the Number of Ions Needed for MD Simulation
J. Chem. Theory Comput., 2018, 14 (4), pp 1823–1827
DOI: 10.1021/acs.jctc.7b01254
Quasi-Diabatic Representation for Nonadiabatic Dynamics Propagation
J. Chem. Theory Comput., 2018, 14 (4), pp 1828–1840
DOI: 10.1021/acs.jctc.7b01178
T3NS: Three-Legged Tree Tensor Network States
Open access through ACS Editors’ Choice
J. Chem. Theory Comput., 2018, 14 (4), pp 2026–2033
DOI: 10.1021/acs.jctc.8b00098
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Journal of Medicinal Chemistry
Beyond the Rule of 5: Lessons Learned from AbbVie’s Drugs and Compound Collection
J. Med. Chem., 2018, 61 (7), pp 2636–2651
DOI: 10.1021/acs.jmedchem.7b00717
Fragment-Based Approach to Targeting Inosine-5′-monophosphate Dehydrogenase (IMPDH) from Mycobacterium tuberculosis
Open access through ACS AuthorChoice
J. Med. Chem., 2018, 61 (7), pp 2806–2822
DOI: 10.1021/acs.jmedchem.7b01622
Discovery of LSZ102, a Potent, Orally Bioavailable Selective Estrogen Receptor Degrader (SERD) for the Treatment of Estrogen Receptor Positive Breast Cancer
J. Med. Chem., 2018, 61 (7), pp 2837–2864
DOI: 10.1021/acs.jmedchem.7b01682
Small-Molecule Activator of UNC-51-Like Kinase 1 (ULK1) That Induces Cytoprotective Autophagy for Parkinson’s Disease Treatment
J. Med. Chem., 2018, 61 (7), pp 2776–2792
DOI: 10.1021/acs.jmedchem.7b01575
Structure-Based Discovery and Optimization of Benzo[d]isoxazole Derivatives as Potent and Selective BET Inhibitors for Potential Treatment of Castration-Resistant Prostate Cancer (CRPC)
J. Med. Chem., 2018, 61 (7), pp 3037–3058
DOI: 10.1021/acs.jmedchem.8b00103.
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The Journal of Physical Chemistry A
Melting of the Au20 Gold Cluster: Does Charge Matter?
Open access through ACS Editors’ Choice
J. Phys. Chem. A, 2018, 122 (16), pp 4092–4098
DOI: 10.1021/acs.jpca.7b12522
Photoinduced Electron Transfer in a BODIPY-ortho-Carborane Dyad Investigated by Time-Resolved Transient Absorption Spectroscopy
J. Phys. Chem. A, 2018, 122 (13), pp 3391–3397
DOI: 10.1021/acs.jpca.8b01539
Comment on “Insights into the Nature of the Chemical Bonding in Thiophene-2-thiol from X-ray Absorption Spectroscopy”
J. Phys. Chem. A, 2018, 122 (14), pp 3711–3712
DOI: 10.1021/acs.jpca.8b00420
Rates of Molecular Vibrational Energy Transfer in Organic Solutions
Published as part of The Journal of Physical Chemistry virtual special issue “Manuel Yáñez and Otilia Mó Festschrift”.
J. Phys. Chem. A, 2018, 122 (14), pp 3535–3540
DOI: 10.1021/acs.jpca.7b12563
Theoretical Kinetic Study of the Unimolecular Keto–Enol Tautomerism Propen-2-ol ↔ Acetone. Pressure Effects and Implications in the Pyrolysis of tert- and 2-Butanol
J. Phys. Chem. A, 2018, 122 (14), pp 3547–3555
DOI: 10.1021/acs.jpca.8b00836
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The Journal of Physical Chemistry B
Structure from Dynamics: Vibrational Dynamics of Interfacial Water as a Probe of Aqueous Heterogeneity
Open access through ACS Editors’ Choice
J. Phys. Chem. B, 2018, 122 (14), pp 3667–3679
DOI: 10.1021/acs.jpcb.7b10574
Empirical Classification of Trajectory Data: An Opportunity for the Use of Machine Learning in Molecular Dynamics
Open access through ACS AuthorChoice
J. Phys. Chem. B, 2018, 122 (13), pp 3230–3241
DOI: 10.1021/acs.jpcb.7b08707
Tribute to Benjamin Widom
This article is part of the Benjamin Widom Festschrift special issue.
J. Phys. Chem. B, 2018, 122 (13), pp 3203–3205
DOI: 10.1021/acs.jpcb.8b00129
Influence of Ion Solvation on the Properties of Electrolyte Solutions
J. Phys. Chem. B, 2018, 122 (14), pp 4029–4034
DOI: 10.1021/acs.jpcb.8b00518
One Peptide Reveals the Two Faces of α-Helix Unfolding–Folding Dynamics
J. Phys. Chem. B, 2018, 122 (14), pp 3790–3800
DOI: 10.1021/acs.jpcb.8b00229
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The Journal of Physical Chemistry C
Effects of Ortho-Phenyl Substitution on the rISC Rate of D–A Type TADF Molecules
J. Phys. Chem. C, 2018, 122 (14), pp 7627–7634
DOI: 10.1021/acs.jpcc.8b01579
High-Open-Circuit-Voltage Solar Cells Based on Bright Mixed-Halide CsPbBrI2 Perovskite Nanocrystals Synthesized under Ambient Air Conditions
J. Phys. Chem. C, 2018, 122 (14), pp 7621–7626
DOI: 10.1021/acs.jpcc.8b01264
First-Principles Screening of All-Inorganic Lead-Free ABX3 Perovskites
J. Phys. Chem. C, 2018, 122 (14), pp 7670–7675
DOI: 10.1021/acs.jpcc.8b02448
Computational Study of Structural and Electronic Properties of Lead-Free CsMI3 Perovskites (M = Ge, Sn, Pb, Mg, Ca, Sr, and Ba)
J. Phys. Chem. C, 2018, 122 (14), pp 7838–7848
DOI: 10.1021/acs.jpcc.8b00226
DFT Study on Sulfur-Doped g-C3N4 Nanosheets as a Photocatalyst for CO2 Reduction Reaction
J. Phys. Chem. C, 2018, 122 (14), pp 7712–7719
DOI: 10.1021/acs.jpcc.8b00098
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The Journal of Physical Chemistry Letters
Lead-Free Perovskite Nanocrystals for Light-Emitting Devices
J. Phys. Chem. Lett., 2018, 9 (7), pp 1573–1583
DOI: 10.1021/acs.jpclett.8b00301
Coherence from Light Harvesting to Chemistry
J. Phys. Chem. Lett., 2018, 9 (7), pp 1568–1572
DOI: 10.1021/acs.jpclett.8b00734
Ultrafast Charge Transfer in Perovskite Nanowire/2D Transition Metal Dichalcogenide Heterostructures
J. Phys. Chem. Lett., 2018, 9 (7), pp 1655–1662
DOI: 10.1021/acs.jpclett.8b00260
Shining Light on New-Generation Two-Dimensional Materials from a Computational Viewpoint
J. Phys. Chem. Lett., 2018, 9 (7), pp 1605–1612
DOI: 10.1021/acs.jpclett.8b00044
Realizing Highly Efficient Solution-Processed Homojunction-Like Sky-Blue OLEDs by Using Thermally Activated Delayed Fluorescent Emitters Featuring an Aggregation-Induced Emission Property
J. Phys. Chem. Lett., 2018, 9 (7), pp 1547–1553
DOI: 10.1021/acs.jpclett.8b00344
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Journal of Proteome Research
Conversations with 100 Scientists in the Field Reveal a Bifurcated Perception of the State of Mass Spectrometry Software
J. Proteome Res., 2018, 17 (4), pp 1335–1339
DOI: 10.1021/acs.jproteome.8b00015
Extending the Compatibility of the SP3 Paramagnetic Bead Processing Approach for Proteomics
J. Proteome Res., 2018, 17 (4), pp 1730–1740
DOI: 10.1021/acs.jproteome.7b00913
PACOM: A Versatile Tool for Integrating, Filtering, Visualizing, and Comparing Multiple Large Mass Spectrometry Proteomics Data Sets
J. Proteome Res., 2018, 17 (4), pp 1547–1558
DOI: 10.1021/acs.jproteome.7b00858
Optimized Phenotypic Biomarker Discovery and Confounder Elimination via Covariate-Adjusted Projection to Latent Structures from Metabolic Spectroscopy Data
Open access through ACS AuthorChoice
J. Proteome Res., 2018, 17 (4), pp 1586–1595
DOI: 10.1021/acs.jproteome.7b00879
Determination of Site-Specific Phosphorylation Ratios in Proteins with Targeted Mass Spectrometry
J. Proteome Res., 2018, 17 (4), pp 1654–1663
DOI: 10.1021/acs.jproteome.7b00911
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Molecular Pharmaceutics
Liposomal Codelivery of Doxorubicin and Andrographolide Inhibits Breast Cancer Growth and Metastasis
Mol. Pharmaceutics, 2018, 15 (4), pp 1618–1626
DOI: 10.1021/acs.molpharmaceut.7b01164
pH-Responsive Nanophotosensitizer for an Enhanced Photodynamic Therapy of Colorectal Cancer Overexpressing EGFR
Mol. Pharmaceutics, 2018, 15 (4), pp 1432–1444
DOI: 10.1021/acs.molpharmaceut.7b00925
A New Method of Constructing a Drug–Polymer Temperature–Composition Phase Diagram Using Hot-Melt Extrusion
Mol. Pharmaceutics, 2018, 15 (4), pp 1379–1391
DOI: 10.1021/acs.molpharmaceut.7b00445
In Vitro, in Silico, and in Vivo Assessments of Intestinal Precipitation and Its Impact on Bioavailability of a BCS Class 2 Basic Compound
Mol. Pharmaceutics, 2018, 15 (4), pp 1607–1617
DOI: 10.1021/acs.molpharmaceut.7b01143
Evaluation of an Anti-HER2 Nanobody Labeled with 225Ac for Targeted α-Particle Therapy of Cancer
Mol. Pharmaceutics, 2018, 15 (4), pp 1457–1466
DOI: 10.1021/acs.molpharmaceut.7b00985
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Organic Process Research & Development
Recent Developments in the Reduction of Aromatic and Aliphatic Nitro Compounds to Amines
Org. Process Res. Dev., 2018, 22 (4), pp 430–445
DOI: 10.1021/acs.oprd.6b00205
Some Items of Interest to Process R&D Chemists and Engineers
Org. Process Res. Dev., 2018, 22 (4), pp 421–429
DOI: 10.1021/acs.oprd.8b00091
N-Butylpyrrolidinone as Alternative Solvent for Solid-Phase Peptide Synthesis
Open access through ACS Editors’ Choice
Org. Process Res. Dev., 2018, 22 (4), pp 494–503
DOI: 10.1021/acs.oprd.7b00389
Photoredox Iridium–Nickel Dual-Catalyzed Decarboxylative Arylation Cross-Coupling: From Batch to Continuous Flow via Self-Optimizing Segmented Flow Reactor
Org. Process Res. Dev., 2018, 22 (4), pp 542–550
DOI: 10.1021/acs.oprd.8b00018
Synthetic Strategies toward SGLT2 Inhibitors
Open access through ACS AuthorChoice
Org. Process Res. Dev., 2018, 22 (4), pp 467–488
DOI: 10.1021/acs.oprd.8b00017