y

[ASAP] lipidr: A Software Tool for Data Mining and Analysis of Lipidomics Datasets

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00082




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[ASAP] Metabolomic Profiling of the Synergistic Effects of Ginsenoside Rg1 in Combination with Neural Stem Cell Transplantation in Ischemic Stroke Rats

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00639




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[ASAP] The Development of RNA-KISS, a Mammalian Three-Hybrid Method to Detect RNA–Protein Interactions in Living Mammalian Cells

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00068




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[ASAP] Optimization of Synovial Fluid Collection and Processing for NMR Metabolomics and LC-MS/MS Proteomics

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00035




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[ASAP] Identification of Putative Early Atherosclerosis Biomarkers by Unsupervised Deconvolution of Heterogeneous Vascular Proteomes

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00118




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[ASAP] Metabolomics and Lipidomics Profiling in Asymptomatic Severe Intracranial Arterial Stenosis: Results from a Population-Based Study

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00644




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[ASAP] Quality Control and Outlier Detection of Targeted Mass Spectrometry Data from Multiplex Protein Panels

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00854




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[ASAP] Quantitative Proteomics Reveals Docosahexaenoic Acid-Mediated Neuroprotective Effects in Lipopolysaccharide-Stimulated Microglial Cells

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00792




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[ASAP] Revealing Dynamic Protein Acetylation across Subcellular Compartments

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00088




y

[ASAP] Characterization of Urinary Exosomes Purified with Size Exclusion Chromatography and Ultracentrifugation

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00693




y

[ASAP] SWATH-MS Analysis of FFPE Tissues Identifies Stathmin as a Potential Marker of Endometrial Cancer in Patients Exposed to Tamoxifen

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00064




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[ASAP] Upregulation of TDRD1 Promotes the Sexual Maturation in Allotetraploids Hybridized from Red Crucian Carp (<italic toggle="yes">Carassius auratus</italic> Red var) (?) and Common Carp (<italic toggle="yes">Cypri

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00008




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[ASAP] Improved Prediction of MHC II Antigen Presentation through Integration and Motif Deconvolution of Mass Spectrometry MHC Eluted Ligand Data

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00874




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[ASAP] His-Tagged Peptidiscs Enable Affinity Purification of the Membrane Proteome for Downstream Mass Spectrometry Analysis

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00022




y

[ASAP] Dried Blood Spot-Based Metabolomic Profiling in Adults with Cystic Fibrosis

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00031




y

[ASAP] Comparative Glycomic Analysis of Exosome Subpopulations Derived from Pancreatic Cancer Cell Lines

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00200




y

[ASAP] Physiological Tau Interactome in Brain and Its Link to Tauopathies

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00137




y

[ASAP] Probing Protein Interaction Networks by Combining MS-Based Proteomics and Structural Data Integration

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00066




y

[ASAP] Complementary Methods for de Novo Monoclonal Antibody Sequencing to Achieve Complete Sequence Coverage

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00223




y

[ASAP] Crystal-C: A Computational Tool for Refinement of Open Search Results

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.0c00119




y

[ASAP] Phosphoproteomics Analysis Reveals a Potential Role of CHK1 in Regulation of Innate Immunity through IRF3

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00829




y

[ASAP] BayesENproteomics: Bayesian Elastic Nets for Quantification of Peptidoforms in Complex Samples

Journal of Proteome Research
DOI: 10.1021/acs.jproteome.9b00468




y

Happy Mother’s Day 2020: Wishes, images, quotes, status, messages, cards, and photos




y

PIX: Bollywood is in bed!

A 21-day lockdown is a long time to spend at home, and Bollywood has been doing all sorts of things to keep themselves busy.




y

Bollywood pix to brighten up your day!

Bollywood stars have been posting stunning pictures during this lockdown.




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PIX: Priyanka, Tiger celebrate Earth Day!

Bollywood stars continue to post pictures with lovely messages on Earth Day.




y

Two-dimensional few-layered PC3 as a promising photocatalyst for overall water splitting

Phys. Chem. Chem. Phys., 2020, 22,9477-9486
DOI: 10.1039/D0CP01392G, Paper
Hui Yao, Qiang Wang, Jianwei Li, Weishan Cai, Yadong Wei, Bin Wang, Jian Wang
A schematic structure and strain related photocatalytic properties at different pH values for the AA pattern of bilayered PC3.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Shifting formic acid dimers into perspective: vibrational scrutiny in helium nanodroplets

Phys. Chem. Chem. Phys., 2020, 22,9637-9646
DOI: 10.1039/D0CP01060J, Paper
Katharina A. E. Meyer, Julia A. Davies, Andrew M. Ellis
A metastable dimer of formic acid has been prepared inside superfluid helium nanodroplets and examined using IR spectroscopy and quantum chemical calculations.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Theoretical study of the mechanism behind the site- and enantio-selectivity of C–H functionalization catalysed by chiral dirhodium catalyst

Phys. Chem. Chem. Phys., 2020, 22,9561-9572
DOI: 10.1039/D0CP00249F, Paper
Meijuan Zhou, Michael Springborg
A detailed mechanism for the high site- and enantio-selectivity of C–H bond functionalization when using a chiral dirhodium catalyst is presented.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Catalytic properties of α-MnO2 for Li–air battery cathodes: a density functional investigation

Phys. Chem. Chem. Phys., 2020, 22,9233-9239
DOI: 10.1039/C9CP06081B, Paper
Khorsed Alam, Nicola Seriani, Prasenjit Sen
Details of the formation and dissociation of the first layer of Li2O2 on the α-MnO2(100) surface as the cathode in Li–air batteries have been studied using first principles density functional theory.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Phase separation in pore-spanning membranes induced by differences in surface adhesion

Phys. Chem. Chem. Phys., 2020, 22,9308-9315
DOI: 10.1039/D0CP00335B, Paper
Open Access
Jeremias Sibold, Vera E. Tewaag, Thomas Vagedes, Ingo Mey, Claudia Steinem
A porous scaffold providing different adhesion energies alters the behaviour of coexisting phases in lipid membranes considerably.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Structural and thermodynamic study of Ca A- or Co B-site substituted SrFeO3−δ perovskites for low temperature chemical looping applications

Phys. Chem. Chem. Phys., 2020, 22,9272-9282
DOI: 10.1039/D0CP01049A, Paper
Open Access
Giancarlo Luongo, Felix Donat, Christoph R. Müller
Partial substitution of the A- or B-site of the perovskite SrFeO3 with Ca or Co, respectively, alters the oxygen transfer properties of the material for chemical looping applications.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Study of the surface species during thermal and plasma-enhanced atomic layer deposition of titanium oxide films using in situ IR-spectroscopy and in vacuo X-ray photoelectron spectroscopy

Phys. Chem. Chem. Phys., 2020, 22,9262-9271
DOI: 10.1039/D0CP00395F, Paper
Sofie S. T. Vandenbroucke, Elisabeth Levrau, Matthias M. Minjauw, Michiel Van Daele, Eduardo Solano, Rita Vos, Jolien Dendooven, Christophe Detavernier
By the powerful combination of in situ FTIR and in vacuo XPS, the surface species during ALD of TDMAT with different reactants could be identified.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Temperature controlled switchable exchange bias and coercivity in spin glass/ferromagnet multilayers under tilting magnetizing

Phys. Chem. Chem. Phys., 2020, 22,9749-9758
DOI: 10.1039/D0CP00605J, Paper
Le Yu, Ruijun Li, Yong Hu
A switch between exchange bias and coercivity is achieved through cooling.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Phosphorylation-dependent conformational changes of arrestin in the rhodopsin–arrestin complex

Phys. Chem. Chem. Phys., 2020, 22,9330-9338
DOI: 10.1039/D0CP00473A, Paper
Dali Wang, Xiangdong Liu, Jianqiang Liu, Chen Song
Conformations of GPCR-bound arrestin depend on the phosphorylation patterns of the GPCR C-loop.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Feed gas exchange (startup/shutdown) effects on Pt/C cathode electrocatalysis and surface Pt-oxide behavior in polymer electrolyte fuel cells as revealed using in situ real-time XAFS and high-resolution STEM measurements

Phys. Chem. Chem. Phys., 2020, 22,9424-9437
DOI: 10.1039/C9CP06895C, Paper
Gabor Samjeské, Takuma Kaneko, Takao Gunji, Kotaro Higashi, Tomoya Uruga, Mizuki Tada, Yasuhiro Iwasawa
Feed gas exchange (startup/shutdown) effects on Pt/C electrocatalysis and surface Pt-oxide behavior in PEFC were investigated by in situ real-time XAFS, synchronized with CV, and high-resolution STEM for the first time.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Photonic crystal enhancement of Raman scattering

Phys. Chem. Chem. Phys., 2020, 22,9630-9636
DOI: 10.1039/D0CP00781A, Paper
Matin Ashurov, Alexander Baranchikov, Sergey Klimonsky
Inverse opal films impregnated with a methylene blue dye were prepared by a template route. Photonic stop band governs amplitude of spontaneous Raman scattering peaks for metal-free photonic crystals, enhancement factor being over 50.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

What does carbon tolerant really mean? Operando vibrational studies of carbon accumulation on novel solid oxide fuel cell anodes prepared by infiltration

Phys. Chem. Chem. Phys., 2020, 22,9815-9823
DOI: 10.1039/D0CP00195C, Paper
Martha M. Welander, Daniel B. Drasbæk, Marie L. Traulsen, Bhaskar R. Sudireddy, Peter Holtappels, Robert A. Walker
In operando studies of carbon formation on novel niobium doped SrTiO3 based SOFC anodes.
The content of this RSS Feed (c) The Royal Society of Chemistry




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A multiporous carbon family with superior stability, tunable electronic structures and amazing hydrogen storage capability

Phys. Chem. Chem. Phys., 2020, 22,9734-9739
DOI: 10.1039/D0CP00469C, Paper
Lianfang Xie, Zheng Wang, Xuechun Xu, Yingxiang Cai
The traditional view that natural allotropes are more stable than artificially synthesized structures is broken.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Giant optical absorption and ferroelectric polarization of BiCoO2S perovskite oxysulfide by first principles prediction

Phys. Chem. Chem. Phys., 2020, Advance Article
DOI: 10.1039/D0CP00057D, Paper
Lijing Wei, Changliang Li, Jianxin Guo, Li Guan, Yinglong Wang, Baoting Liu
Obtaining an ideal ferroelectric photovoltaic (FE-PV) materials BiCoO2S with a giant absorption coefficient and ferroelectric polarization.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Unveiling the atomic defects and electronic structure of Cu2.2Zn0.8SnSe4−xTex (x = 0 to 0.04) by X-ray absorption fine structure spectroscopy

Phys. Chem. Chem. Phys., 2020, 22,9362-9367
DOI: 10.1039/D0CP01153C, Paper
Weifeng Huang, Yingcai Zhu, Yong Liu, Lijuan Liu, Changchun Yang, Wei Xu
CuZn anti-site defects and oxygen interstitial defects in a quaternary compound, Cu2.2Zn0.8SnSe4, are revealed by X-ray absorption fine structure spectroscopy.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

The interfacial structure and dynamics in a polymer nanocomposite containing small attractive nanoparticles: a full atomistic molecular dynamics simulation study

Phys. Chem. Chem. Phys., 2020, Advance Article
DOI: 10.1039/D0CP00799D, Paper
Xiang-Meng Jia, Hu-Jun Qian, Zhong-Yuan Lu
We study the interfacial structure and dynamics of a polymer nanocomposite (PNC) composed of octaaminophenyl polyhedral oligomeric silsesquioxane (OAPS) and poly(2-vinylpyridine) (P2VP) by performing full atomistic molecular dynamics simulations.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Temperature-cycle electron paramagnetic resonance

Phys. Chem. Chem. Phys., 2020, 22,9487-9493
DOI: 10.1039/D0CP00664E, Paper
Open Access
E. Gabriele Panarelli, Peter Gast, Edgar J. J. Groenen
Temperature-cycle EPR, a novel approach to follow a chemical reaction in the cavity of an EPR spectrometer.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

N-Promoted Ru1/TiO2 single-atom catalysts for photocatalytic water splitting for hydrogen production: a density functional theory study

Phys. Chem. Chem. Phys., 2020, Advance Article
DOI: 10.1039/D0CP00929F, Paper
Zhibo Luo, Zhijie Wang, Jia Li, Kang Yang, Gang Zhou
In our Ru1–N1/TiO2 single-atom catalyst system, isolated Ru1 atoms act as active sites for the reduction of protons, and the TiO2 support offers the photogenerated carriers, allowing for a hydrogen evolution activity comparable to that of Pd.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Molecular origins of bulk viscosity in liquid water

Phys. Chem. Chem. Phys., 2020, 22,9494-9502
DOI: 10.1039/D0CP01560A, Paper
Ahmad Yahya, Luoxi Tan, Stefania Perticaroli, Eugene Mamontov, Daniel Pajerowski, Joerg Neuefeind, Georg Ehlers, Jonathan D. Nickels
The shear viscous response of water is closely associated with changes in network connectivity on the sub ps timescale. The bulk viscous response is shown here to be associated with local density fluctuations and rotational motion around 1–3 ps.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Computational insights into the strain effect on the electrocatalytic reduction of CO2 to CO on Pd surfaces

Phys. Chem. Chem. Phys., 2020, 22,9600-9606
DOI: 10.1039/D0CP01042A, Paper
Hong Liu, Jian Liu, Bo Yang
Electroreduction of CO2 to CO was investigated using DFT and microkinetic modeling on strained Pd surfaces with adsorbate–adsorbate interactions included.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Selective host–guest chemistry, self-assembly and conformational preferences of m-xylene macrocycles probed by ion-mobility spectrometry mass spectrometry

Phys. Chem. Chem. Phys., 2020, 22,9290-9300
DOI: 10.1039/C9CP06938K, Paper
Benjamin A. Link, Ammon J. Sindt, Linda S. Shimizu, Thanh D. Do
Ion-mobility spectrometry mass spectrometry successfully captures selective host–guest chemistry of m-xylene macrocycles; notably, a tetrahedral, dimeric Zn complex.
The content of this RSS Feed (c) The Royal Society of Chemistry




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Effects of non-halogenated solvent on the main properties of a solution-processed polymeric thin film for photovoltaic applications: a computational study

Phys. Chem. Chem. Phys., 2020, 22,9693-9702
DOI: 10.1039/D0CP01303J, Paper
Karlisson Rodrigo de Almeida Sousa, Leandro Benatto, Luana Wouk, Lucimara Stolz Roman, Marlus Koehler
Our nano-scale simulations of polymeric films processed with different solvents reveal important details of morphological and electrical changes important for OPV applications.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Monolayer Bi2Se3−xTex: novel two-dimensional semiconductors with excellent stability and high electron mobility

Phys. Chem. Chem. Phys., 2020, 22,9685-9692
DOI: 10.1039/D0CP00729C, Paper
Yifan Liu, Yuanfeng Xu, Yanju Ji, Hao Zhang
The bandgaps for monolayers Bi2Se3, Bi2Se2Te and Bi2SeTe2 decrease under moderate strains ranging from −4% to 10%, and the predicted electron mobilities are high, reaching 2708 cm2 V−1 s−1 for Bi2SeTe2.
The content of this RSS Feed (c) The Royal Society of Chemistry




y

Origin of short- and medium-range order in supercooled liquid Ge3Sb2Te6 using ab initio molecular dynamics simulations

Phys. Chem. Chem. Phys., 2020, 22,9759-9766
DOI: 10.1039/D0CP00389A, Paper
Chong Qiao, Y. R. Guo, Songyou Wang, Yu Jia, Cai-Zhuang Wang, Kai-Ming Ho
The disordered clusters in Ge3Sb2Te6 change to ordered octahedrons by adjustment of the bond-angle relationship as the temperature decreases.
The content of this RSS Feed (c) The Royal Society of Chemistry