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排序方式: 共有318条查询结果,搜索用时 15 毫秒
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2.
Shobhit S. Chaturvedi Rajeev Ramanan Sodiq O. Waheed Jon Ainsley Martin Evison Jennifer M. Ames Christopher J. Schofield Tatyana G. Karabencheva-Christova Christo Z. Christov 《Chemistry (Weinheim an der Bergstrasse, Germany)》2019,25(21):5422-5426
The human KDM7 subfamily histone H3 Nϵ-methyl lysine demethylases PHF8 (KDM7B) and KIAA1718 (KDM7A) have different substrate selectivities and are linked to genetic diseases and cancer. We describe experimentally based computational studies revealing that flexibility of the region linking the PHD finger and JmjC domains in PHF8 and KIAA1718 regulates interdomain interactions, the nature of correlated motions, and ultimately H3 binding and demethylation site selectivity. F279S an X-linked mental retardation mutation in PHF8 is involved in correlated motions with the iron ligands and second sphere residues. The calculations reveal key roles of a flexible protein environment in productive formation of enzyme-substrate complexes and suggest targeting the flexible KDM7 linker region is of interest from a medicinal chemistry perspective. 相似文献
3.
Caroline K. Williams Gavin A. McCarver Ashwin Chaturvedi Dr. Soumalya Sinha Marcus Ang Prof. Konstantinos D. Vogiatzis Prof. Jianbing “Jimmy” Jiang 《Chemistry (Weinheim an der Bergstrasse, Germany)》2022,28(52):e202201323
Electrocatalytic hydrogen gas production is considered a potential pathway towards carbon-neutral energy sources. However, the development of this technology is hindered by the lack of efficient, cost-effective, and environmentally benign catalysts. In this study, a main-group-element-based electrocatalyst, SbSalen , is reported to catalyze the hydrogen evolution reaction (HER) in an aqueous medium. The heterogenized molecular system achieved a Faradaic efficiency of 100 % at −1.4 V vs. NHE with a maximum current density of −30.7 mA/cm2. X-ray photoelectron spectroscopy of the catalyst-bound working electrode before and after electrolysis confirmed the molecular stability during catalysis. The turnover frequency was calculated as 43.4 s−1 using redox-peak integration. The kinetic and mechanistic aspects of the electrocatalytic reaction were further examined by computational methods. This study provides mechanistic insights into main-group-element electrocatalysts for heterogeneous small-molecule conversion. 相似文献
4.
Ekta Rani Alka A. Ingale A. Chaturvedi C. Kamal D. M. Phase M. P. Joshi A. Chakrabarti A. Banerjee L. M. Kukreja 《Journal of Raman spectroscopy : JRS》2016,47(4):457-467
Raman spectroscopy/mapping is used to investigate the variation of Si phonon wavenumbers, i.e., lower wavenumber (LW ~ 495–510 cm−1) and higher wavenumber (HW ~ 515–519 cm−1) phonons, observed in Si–SiO2 multilayer nanocomposite (NCp) grown using pulsed laser deposition. Sensitivity of Raman spectroscopy as a local probe to surface/interface is effectively used to show that LW and HW phonons originate at surface (Si–SiO2 interface) and core of Si nanocrystals, respectively. The consistent picture of this understanding is developed using Raman spectroscopy monitored laser heating/annealing and cooling experiment at the site of the desired wavenumber, chosen with the help of Raman mapping. Raman spectra calculations for Si41 cluster with oxygen and hydrogen termination show strong mode at 512 cm−1 for oxygen terminated cluster corresponding to the vibration of surface Si atoms. This supports our attribution of LW phonons to be originating at the Si–SiO2 surface/interface. These results along with XPS show that nature of interface (oxygen bonding) in turn depends on the size of nanocrystals and LW phonons originate at the surface of smaller Si nanocrystals. The understanding developed can conclude the ongoing debate on large variation in Si phonon wavenumbers of Si–SiO2 NCps in the literature. Copyright © 2015 John Wiley & Sons, Ltd. 相似文献
5.
Chokalingam Saravanan Marimuthu Senthilkumaran Bosco Christin Maria Arputham Ashwin Palaniswamy Suresh Paulpandian Muthu Mareeswaran 《Journal of inclusion phenomena and macrocyclic chemistry》2017,87(3-4):239-250
The ligand salt, Me6[14]diene·2HClO4 (L·2HClO4) was prepared by condensation of acetone and ethylene diamine in the presence of perchloric acid. On reduction of this diene ligand salt, L·2HClO4 with sodium borohydride, the two isomeric ligands, ‘tet-a’ and ‘tet-b’ were produced. The ligands, on reaction with ZnX2 (X=Cl, ClO4, NO3 or CH3COO) and ZnSO4 produced the corresponding complexes. These complexes have been characterized on the basis of elemental analyses; IR, UV–Vis and 1H-NMR spectroscopies; magnetic and conductance data. Based on these data, all of the complexes of the diene ligand L, as well as the perchlorate complexes of all of the ligands attained a square-pyramidal arrangement, whereas the complexes of ‘tet-a’ and ‘tet-b’, with X=NO3, Cl or CH3COO and with ZnSO4 salt, were octahedral. Moreover, all complexes were monometallic except the nitrato complex, [(ZnL)2(µ-NO3)](ClO4)3 which is bimetallic. The structure of [(ZnL)2(µ-NO3)](ClO4)3 has been confirmed by X-ray crystallography. In this complex the zinc centres lie within a N4O donor set, with the four nitrogen donors from L and one of the oxygen atom stemming from the bridging NO3. The complexes show different electrolytic behavior in different solvents. The antibacterial activities of the ligands and complexes towards different phytopathogenic bacteria have been investigated. 相似文献
6.
Bosco Christin Maria Arputham Ashwin Chokalingam Saravanan Marimuthu Senthilkumaran Ragupathi Sumathi Palanisamy Suresh 《Supramolecular chemistry》2018,30(1):32-41
The host–guest interaction of α-tocopherol (vitamin E) with p-sulfonatocalix[4]arene (p-SC4) in solution state is studied using emission and cyclic voltammetric techniques. The lipid soluble α-tocopherol (α-T) forms a solid complex with p-SC4. FTIR and NMR spectral analysis of the solid complex reveals the tight packing of α-T inside the cavity of p-SC4. The structural deformation is confirmed by XRD analysis. SEM images differentiate the highly porous gel like structure of vitamin E aggregate and the solid structure of the host–guest complex prepared. NOESY spectra confirm the tight penetration of α-T within the hydrophobic cavity of p-SC4. 相似文献
7.
Franklin A. Davis Bin Yang Jianghe Deng Yongzhong Wu Yulian Zhang Ashwin Rao 《Phosphorus, sulfur, and silicon and the related elements》2013,188(5-6):1109-1117
Abstract Sulfinimine-derived polyfunctionalized chiral building blocks, often prepared in one pot, provide efficient access, with a minimum of chemical manipulation, to enantiopure, multifunctional amine derivatives including piperidines and pyrrolidines. 相似文献
8.
Caroline K. Williams Amir Lashgari Nilakshi Devi Marcus Ang Ashwin Chaturvedi Pranita Dhungana Prof. Jianbing Jimmy Jiang 《Chemistry (Weinheim an der Bergstrasse, Germany)》2021,27(20):6240-6246
In this work, the electrocatalytic reduction of dichloromethane (CH2Cl2) into hydrocarbons involving a main group element-based molecular triazole-porphyrin electrocatalyst H2PorT8 is reported. This catalyst converted CH2Cl2 in acetonitrile to various hydrocarbons (methane, ethane, and ethylene) with a Faradaic efficiency of 70 % and current density of −13 mA cm−2 at a potential of −2.2 V vs. Fc/Fc+ using water as a proton source. The findings of this study and its mechanistic interpretations demonstrated that H2PorT8 was an efficient and stable catalyst for the hydrodechlorination of CH2Cl2 and that main group catalysts could be potentially used for exploring new catalytic reaction mechanisms. 相似文献
9.
N. Kumar S. K. Jha S. S. Chaturvedi 《Journal of Radioanalytical and Nuclear Chemistry》2011,290(3):525-533
Radiation dose-risk assessment was carried out for cereal species Brassica compestris var. dichotoma, Oryza sativa var. Shalum1, Zea mays, Lactuca indica, Cumunis sativum, and Clocasia esculanta due to naturally available radionuclides 40K, 238U and 232Th in Domiasiat area. The activity in biota and corresponding soil was measured by precipitation method using NaI(TI) detector.
Transfer factor (TF) was for Oryza spp. (1.00E−01-40K, 8.76E−05-232Th, and 9.11E−05-238U), for Brassica spp. (5.39E−01-40K, 8.17E−04-232Th and 2.96E−04-238U) and for Zea spp. (3.41E−01-40K, 5.84E−05-232Th, 8.87E−05-238U) etc., respectively. A detailed physio-morphological study of the biota and extensive investigation of ecosystem was carried
out for assessment. The data was modeled using FASSET for dose estimation and obtained total dose was 1.58E−04
\upmu Gy h-1 \upmu \hbox{Gy}\,h^{-1} in Oryza spp., 2.87E−04
\upmu Gy h-1 \upmu \hbox{Gy}\,h^{-1}
Brassica spp. and 6.90E−03
\upmu Gy h-1 \upmu \hbox{Gy}\,h^{-1} in Zea spp. etc. The dose was compared with the UNSCEAR dataset for screening level dose for biota. Zea spp. was more susceptible for the chronic radiation exposure. 相似文献
10.
A. K. Chaturvedi D. Chaturvedi N. Mishra V. Mishra 《Journal of the Iranian Chemical Society》2011,8(2):396-400
A novel Mitsunobu-based protocol has been developed for the synthesis of carbazates and dithiocarbazates through the variety of corresponding primary, secondary and tertiary alcohols and various kinds of substituted hydrazines using Mitsunobu??s reagent and CO2/CS2 system, in good to excellent yields. 相似文献