Marina Chang, Winnie Huang, Gatha Shambharkar, Kenny Hernandez, Danielle Jamie Mai
Biopolymer sequences dictate their functions, and protein-based polymers are a promising platform to establish sequence–function relationships for novel biopolymers. To efficiently explore vast sequence spaces of natural proteins, sequence repetition...
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Polymer chemistry informed neural networks (PCINNs) for data-driven modelling of polymerization processes

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Polym. Chem., 2024, 15,4580-4590
DOI: 10.1039/D4PY00995A, Paper

Nicholas Ballard, Jon Larrañaga, Kiarash Farajzadehahary, José M. Asua
A method for training neural networks to predict the outcome of polymerization processes is described that incorporates fundamental chemical knowledge. This permits generation of data-driven predictive models with limited datasets.
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Structural isomerism engineering regulates molecular AIE behavior and application in visualizing endogenous hydrogen sulfide

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J. Mater. Chem. B, 2024, 12,11134-11141
DOI: 10.1039/D4TB01617C, Paper

Yaxi Li, Yong-Xiang Wang, Dujuan Liu, Chen-Chieh Ni, Jianming Ni, Jen-Shyang Ni
The isomerization effect on coumarin-based AIEgens was systematically analyzed and further applied to H₂S detection.
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Development of enzymatically crosslinked natural deep eutectogels: versatile gels for enhanced drug delivery

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J. Mater. Chem. B, 2024, Advance Article
DOI: 10.1039/D4TB01672F, Paper

Liane Meneses, Dimitra Antonia Bagaki, Ana Roda, Alexandre Paiva, Ana Rita C. Duarte
We propose a new injectable eutectogel prepared by enzymatic crosslinking, using NADES, betaine : glycerol (2 : 1), as solvent. The potential of using this material with improved rheological properties as drug delivery system, has also been evaluated.
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PIX: Sasural Simar Ka's Dipika-Shoaib get married

By www.rediff.com
Published On :: Fri, 23 Feb 2018 13:45:39 +0530

Congratulations, Dipika, Shoaib!

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Sasural Simar Ka's Dipika at her real sasural

By www.rediff.com
Published On :: Tue, 06 Mar 2018 14:16:43 +0530

Dipika's grand welcome in her sasural!

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Kalidasa, the poet of the natural world

By www.thehindubusinessline.com
Published On :: Fri, 03 Sep 2021 09:23:36 +0530

As it rains, it is natural to turn to the epic writer whose verses bring home the monsoons and the plants in which the season become visible

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Imaging specific proteins in living cells with small unnatural amino acid attached Raman reporters

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Analyst, 2024, 149,5476-5481
DOI: 10.1039/D4AN00758A, Paper

Erli Cai, Yage Chen, Jing Zhang, Haozheng Li, Yiran Li, Shuai Yan, Zhiyong He, Quan Yuan, Ping Wang
For living HeLa cells, we report a small and minimally-invasive Raman reporter (about 2 aa and <1 kDa), which can be site-specifically introduced into proteins by genetic codon expansion combined with tetrazine ligation.
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An improved cancer diagnosis algorithm for protein mass spectrometry based on PCA and a one-dimensional neural network combining ResNet and SENet

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Analyst, 2024, Advance Article
DOI: 10.1039/D4AN00784K, Paper

Liang Ma, Wenqing Gao, Xiangyang Hu, Dongdong Zhou, Chenlu Wang, Jiancheng Yu, Keqi Tang
An improved cancer diagnosis algorithm for protein mass spectrometry based on PCA and 1D neural network combining ResNet and SENet is proposed and successfully applied to the diagnosis of ovarian cancer with high accuracy and strong fitting ability.
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Structural determination of fructooligosaccharides and raffinose family oligosaccharides using logically derived sequence tandem mass spectrometry

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Analyst, 2024, Advance Article
DOI: 10.1039/D4AN00872C, Paper

Chia Yen Liew, Wun-Long Li, Chi-Kung Ni
Logical procedures for structural determination of fructooligosaccharides and raffinose family oligosaccharides.
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Amidst tubers, roots in a rural set up

By www.thehindubusinessline.com
Published On :: Thu, 24 Jan 2013 13:03:21 +0530

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A J Vinayak

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Densification of sodium and magnesium aluminosilicate glasses at ambient temperature: structural investigations by solid-state nuclear magnetic resonance and molecular dynamics simulations

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Phys. Chem. Chem. Phys., 2024, 26,27348-27362
DOI: 10.1039/D4CP02431A, Paper

Millena Logrado, Yara Hellen Firmo Gomes, Tomiki Inoue, Shingo Nakane, Yoshinari Kato, Hiroki Yamazaki, Akihiro Yamada, Hellmut Eckert
Superposition of ¹⁷O triple-quantum magic-angle spinning NMR spectra of 20MgO–20Al₂O₃–60SiO₂ (MAS**) and 20Na₂O–20Al₂O₃–60SiO₂ (NAS**) glasses prepared at ambient pressure (AP) and pressurized and decompressed at 25 GPa at room temperature (HP(25)).
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Structural and sorption characteristics of an aerogel composite material loaded with flufenamic acid: insights from MAS NMR and high-pressure NOESY studies

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Phys. Chem. Chem. Phys., 2024, 26,27301-27313
DOI: 10.1039/D4CP03217A, Paper

Valentina V. Sobornova, Valeriya V. Mulloyarova, Konstantin V. Belov, Alexey A. Dyshin, Peter M. Tolstoy, Mikhail G. Kiselev, Ilya A. Khodov
The structural and sorption characteristics of a composite material consisting of a silica aerogel loaded with flufenamic acid were investigated using a variety of nuclear magnetic resonance techniques.
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Structural insights into carboxylic-acid based DES across H-bond donor ratios: impact of CL&Pol refinement

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Phys. Chem. Chem. Phys., 2024, 26,27486-27497
DOI: 10.1039/D4CP03233K, Paper

Jon Zubeltzu, Elixabete Rezabal
Improved force field parameters refine H-bond network and long-range structure in carboxylic-acid-based deep eutectic solvents.
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Structural Distortion Driven Polaronic Transport and Table-like Magnetocaloric Properties in Polycrystalline Tb0.7Sr0.3MnO3 compound

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Phys. Chem. Chem. Phys., 2024, Accepted Manuscript
DOI: 10.1039/D4CP03760J, Paper

Dipak Mazumdar, I. Das, Kalipada Das
This research mainly explores the structural, magnetic, magneto-transport, and magnetocaloric properties of the polycrystalline Tb0.7Sr0.3MnO3 compound. The results reveal a signiﬁcant modiﬁcation of the compound’s ground state with increasing the...
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Riyadh Season 2024: As part of cultural diplomacy, Saudi Arabia celebrates Indian diversity in mega tourism event

By www.thehindu.com
Published On :: Mon, 21 Oct 2024 21:01:33 +0530

The Indian diaspora in Saudi Arabia has grown over the years and with 2.4 million expat workers it has the second largest number of foreign workers in Saudi Arabia

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French artist Charles Foussard brings his mural art to Hyderabad

By www.thehindu.com
Published On :: Thu, 24 Oct 2024 13:56:16 +0530

Painted as part of the fourth edition of the Wall Art Festival, Charles Foussard’s mural explores the interconnectedness between humans and the Universe

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Thermally activated structural phase transitions and processes in metal–organic frameworks

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Chem. Soc. Rev., 2024, 53,3606-3629
DOI: 10.1039/D3CS01105D, Review Article

Open Access

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Celia Castillo-Blas, Ashleigh M. Chester, David A. Keen, Thomas D. Bennett
The structural knowledge of metal–organic frameworks is crucial for understanding and developing new efficient materials for industrial implementation.
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Visible light-activated polyphenol–Al3+ coordination for ambient and quantitative xylose-to-furfural conversion

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Chem. Commun., 2024, Advance Article
DOI: 10.1039/D4CC04899G, Communication

Jinshu Huang, Qizhi Luo, Tengyu Liu, Song Yang, Hu Li
Visible light-enhanced coordination of polyphenol–Al³⁺ is uncovered to switch Lewis/Brønsted acid sites for room-temperature cascade upgrading of xylose to furfural in ultrahigh yields.
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Revealing the structural influence mechanism of intrinsic potassium/calcium elements on bio-waste-derived hard carbon for sodium-ion batteries

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Chem. Commun., 2024, 60,13380-13383
DOI: 10.1039/D4CC03546A, Communication

Yinghao Zhang, Chun Wu, Qinghang Chen, Chuangchuang Li, Wenjie Huang, Qianxiong Wen, Xiang-Xi He, Xingqiao Wu, Shu-Lei Chou
The evolution mechanism of hard carbon structures in terms of graphitization and pore structure caused by K/Ca has been clarified.
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The structural, electronic and thermodynamic properties of the designed p-benzoquinone based dicationic ionic liquids: insight from DFT–GD3 and QTAIM

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Mol. Syst. Des. Eng., 2024, Advance Article
DOI: 10.1039/D4ME00119B, Paper

Hossein Roohi, Sajedeh Habibipour, Khatereh Ghauri
In this work, physicochemical properties of the dicationic ionic liquids [BTAD][A1–8]₂ ([BTAD]²⁺ = [p-C₆O₂(N₃H₂)₂]²⁺ and A1–8 = [CH₃CO₂]⁻, [CF₃CO₂]⁻, [N(CN)₂]⁻, [CF₃SO₃]⁻, [ClO₄]⁻, [BF₄]⁻, [NTf₂]⁻ and [PF₆]⁻) were theoretically investigated.
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Self-supervised graph neural networks for polymer property prediction

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Mol. Syst. Des. Eng., 2024, 9,1130-1143
DOI: 10.1039/D4ME00088A, Paper

Open Access

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Qinghe Gao, Tammo Dukker, Artur M. Schweidtmann, Jana M. Weber
Self-supervised learning for polymer property prediction in scarce data domains.
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Scriptural literacy

By www.thehindu.com
Published On :: Wed, 24 Aug 2016 01:59:15 +0530

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Faith

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Temperature-dependent structural and optical properties of Sb-doped SnO2 nanoparticles and their electrochemical analysis for supercapacitor application

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Published On ::

New J. Chem., 2024, Advance Article
DOI: 10.1039/D4NJ00918E, Paper

Towseef Ahmad, Mohd Zubair Ansari
Transparent conducting oxides (TCOs) play an important role in advanced energy harvesting and storage systems, as well as cutting-edge display technology.
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Structural optimization of icaritin for advanced cancer: novel carbamates via oral administration

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New J. Chem., 2024, Advance Article
DOI: 10.1039/D3NJ05723B, Paper

Fengxiao Li, Weiping Wang, Jiaqi Fan, Yixiu Zhai, Jiaming Zhang, Tianhong Zhang, Qikun Jiang
Carbamates of icaritin (3N-Me and 3N-Et) are synthesized first to overcome the challenge of the phase II metabolism of ICT. 3N-Me has potential as a novel advanced cancer treatment agent via oral administration in the future.
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Impact of Cr doping on the structural and optoelectronic properties of a CsPbIBr2 perovskite solar cell

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New J. Chem., 2024, 48,7205-7212
DOI: 10.1039/D4NJ00681J, Paper

M. I. Khan, Ali Mujtaba, Saddam Hussain, Asif Hussain, Dalil Bulayis N AlResheedi, Zainab Mufarreh Elqahtani, El Sayed Yousef, Norah Alwadai
The Cr–CsPbIBr₂ device showed enhanced performance, with increased grain size, reduced energy band gap, and elevated efficiency from 9.64% to 12.06%.
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Guanidine modification improves functions of natural RNA-targeting alkaloids

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New J. Chem., 2024, Advance Article
DOI: 10.1039/D3NJ05833F, Communication

Open Access

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Tamaki Endoh, Sagar Satpathi, Yutong Chen, Saki Matsumoto, Tatsuya Ohyama, Peter Podbevšek, Janez Plavec, Kazumitsu Onizuka, Fumi Nagatsugi, Naoki Sugimoto
Guanidine modification on berberine improved RNA binding affinity and enhanced suppression of protein expression.
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Catalytic oxidative desulfurization performance of a modified nano-sized β zeolite loaded with different structural polyoxometalates

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New J. Chem., 2024, Advance Article
DOI: 10.1039/D4NJ00214H, Paper

Jinhong Li, Haonan Li, Zhimei Song, Ying Guo, Mengxiao Tai, Mei Han, Xinyao Wang, Lidong Chen, Dongmei Ren
HPW/β-T+S has the best desulfurization activity among the composite catalysts supported by polyoxometalates with different structures.
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The weekend cultural scene in Bengaluru

By www.thehindu.com
Published On :: Fri, 25 Nov 2022 11:17:21 +0530

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Leisure

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Construction of a nontoxic nano-pesticide and its co-application with natural predators for perfect cooperative pest management: an innovative strategy for pesticide reduction

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Environ. Sci.: Nano, 2024, Advance Article
DOI: 10.1039/D4EN00060A, Paper

Shangyuan Wu, Qinhong Jiang, Chunyang Huang, Hailin Yang, Changhua Zhang, Meizhen Yin, Jie Shen, Shuo Yan, Hu Li
The current study develops a nano-pesticide that is nontoxic toward the predatory stinkbug but with enhanced bioactivity toward the common cutworm, which proposes to co-apply the nano-pesticide with predator as an innovative pest control technique.
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Magnetic and structural characteristics associated with the transformation of As(V)-coprecipitated ferrihydrite to hematite: implications for magnetic enhancement in soils and sediments

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Environ. Sci.: Nano, 2024, Advance Article
DOI: 10.1039/D3EN00739A, Paper

Guoqing Zhang, Yixuan Tang, Jinru Lin, Jiaxing Xu, Zidan Yuan, Lingyun Chen, Fei Wu, Chengshuai Liu, Zongmin Zhu, Xiangyang Bi, Wei Zou, Zhiguo Cao, Kai Jiang, Yuanming Pan, Roman Chernikov, Yongfeng Jia, Shaofeng Wang
The transformation of metastable ferrihydrite to stable hematite has been linked to magnetic enhancement in soils and sediments.
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Macro- and micro-structural manifestation and engineering of large-size polycrystalline ZnSe

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CrystEngComm, 2024, 26,1986-1993
DOI: 10.1039/D3CE01243C, Paper

Xiaobo Zhao, Cong Zhang, Zhengping Wang, Dazhi Lu, Haohai Yu, Huaijin Zhang
Polycrystalline ZnSe materials with sizes of 100 mm were grown by the CVD method, and their constitution structures and defects were investigated to analyze the influence of the preparation conditions on the optical transmission properties of the materials.
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New 8-hydroxy quinoline-polycyclic aromatic hydrocarbon (PAH) conjugates and their sulfonated derivatives: effects of sulfonation and PAH size on their structural, supramolecular and cytotoxic properties

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CrystEngComm, 2024, Advance Article
DOI: 10.1039/D4CE00105B, Paper

Suman Sehlangia, Surbhi Dogra, Prosenjit Mondal, Chullikkattil P. Pradeep
The ring size of polycyclic aromatic hydrocarbons (PAHs) and sulfonation affect the supramolecular interactions and cytotoxic properties of a new series of 8-hydroxy quinoline-PAH conjugates.
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The structural evolution of CL-20-based energetic host–guest solvates at decomposition temperature according to the perceptions of THz spectroscopy

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CrystEngComm, 2024, Advance Article
DOI: 10.1039/D3CE01310C, Paper

Lu Shi, XiaoHui Duan, Hongzhen Li
This work employed variable-temperature THz spectroscopy to analyze the structural evolution of host–guest energetic CL-20/H₂O₂ and CL-20/H₂O solvates, as well as the mechanism of intermolecular interactions using DFT calculation and MD simulation.
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Structural diversity and tetrel bonding significance in lead(II) complexes with pyrazoylisonicotinoylhydrazone and varied anionic co-ligands

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CrystEngComm, 2024, Accepted Manuscript
DOI: 10.1039/D4CE00325J, Paper

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Ghodrat Mahmoudi, Isabel Garcia-Santos, Roi Fernández-Vázquez, Rosa Maria Gomila, Alfonso Castineiras, Esmail Doustkhah, Ennio Zangrando, Antonio Frontera
Four lead(II) complexes featuring pyrazoylisonicotinoylhydrazone ligand paired with various anionic co-ligands (azido, thiocyanato, nitrito, and nitrato) were synthesized and thoroughly examined using structural, analytical, and spectroscopic techniques. These ligands, in...
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Structural chemistry of decalins and perfluorodecalins

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CrystEngComm, 2024, Advance Article
DOI: 10.1039/D3CE01117H, Paper

Bartłomiej Paska, Grzegorz Cichowicz, Patryk Rzepiński, Michał Ksawery Cyrański, Łukasz Dobrzycki, Roland Boese
Crystaline phases of decalins and perfluorodecalins.
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Orthogonal stimulation of structural transformations in photo-responsive MOF films through linker functionalization

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CrystEngComm, 2024, Advance Article
DOI: 10.1039/D4CE00221K, Communication

Open Access

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Sumea Klokic, Benedetta Marmiroli, Denys Naumenko, Giovanni Birarda, Simone Dal Zilio, Miriam de J. Velásquez-Hernández, Paolo Falcaro, Lisa Vaccari, Heinz Amenitsch
Controlling the magnitude of structural dynamics in flexible MOF films by an applied stimulus is largely desired for specific applications such as energy storage.
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Synthesis and structural trends in a series of simple tetraalkylphosphonium salts

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CrystEngComm, 2024, Accepted Manuscript
DOI: 10.1039/D4CE00210E, Paper

Jakub Gawraczynski, Piotr J Leszczynski, Michal Ksawery Cyranski, Łukasz Dobrzycki, Wiktor Koźmiński, Karol J. Fijalkowski, Wojciech Grochala, Tomasz Jaroń
A series of sulfates (S) and hydrogen sulfates (HS) containing tetramethylphosphonium (TMP), tetraethylphosphonium (TEP) and tetrabutylphosphonium (TBP) cations have been prepared from the respective bromides using ion metathesis reactions. The...
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Rural retail inflation in 23 States/UTs higher than urban

By www.thehindubusinessline.com
Published On :: Fri, 13 Jan 2023 18:57:52 +0530

Experts say elevated rural inflation likely to hurt the rural economy, as the pricing power is not with the rural households

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Economy

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How a Dharavi-based housemaid inspired rural financial start-up Jai Kisan

By www.thehindubusinessline.com
Published On :: Wed, 16 Aug 2023 19:03:34 +0530

The digital financial services firm eyes onboarding 1 million farmers before fiscal end

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Agri Business

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CPI(M) went after trolley bag to hide government failure, says Muraleedharan

By www.thehindu.com
Published On :: Sun, 10 Nov 2024 21:11:15 +0530

Both the State and Union governments are uninterested in people’s issues, says the Congress leader

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Kerala

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Bengal cultural festival kicks off in Thrissur

By www.thehindu.com
Published On :: Mon, 11 Nov 2024 20:55:17 +0530

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Kerala

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At APMCs, no takers for agricultural produce

By www.thehindu.com
Published On :: Tue, 15 Nov 2016 08:26:07 +0530

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Mumbai Local

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