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“Calculation of P,T-odd interaction constant of PbF using Z-vector method in the relativistic coupled-cluster framework”, Journal of Chemical Physics, vol. 143, no. 8, p. 084119, 2015.
, “Can Li atoms anchored on boron- and nitrogen-doped graphene catalyze dinitrogen molecules to ammonia? a DFT study”, ChemPhysChem, vol. 24, no. 12, 2023.
, “Can main group systems act as superior catalysts for dihydrogen generation reactions? A computational investigation”, Dalton Transactions, vol. 45, no. 14, pp. 5968-5977, 2016.
, “Can molecular cages be effective at small molecule activation? a computational investigation”, Inorganic Chemistry, vol. 52, no. 8, pp. 4238-4243, 2013.
, “Can silylenes rival transition metal systems in bond-strengthening pi-back donation? a computational investigation”, Chemical Communications, vol. 50, no. 62, pp. 8522-8525, 2014.
, “Can substituted allenes be highly efficient leaving groups in catalytic processes? a computational investigation”, Journal of Computational Chemistry, vol. 36, no. 11, pp. 795-804, 2015.
, “Can the solvent enhance the rate of chemical reactions through C-H/pi interactions? insights from theory”, Physical Chemistry Chemical Physics, vol. 21, no. 27, pp. 14821-14831, 2019.
, “Can we identify the salt-cocrystal continuum state using XPS?”, Crystal Growth & Design, vol. 21, no. 2, pp. 735-747, 2021.
, “CAP/EOM-CCSD method for the study of potential curves of resonant states”, Physical Chemistry Chemical Physics, vol. 15, no. 41, pp. 17915-17921, 2013.
, “Capturing a novel metastable polymorph of the anticancer drug gefitinib”, CrystEngComm, vol. 16, no. 37, pp. 8638-8641, 2014.
, “Carbohydrate recognition using metal-ligand assemblies”, Organic & Biomolecular Chemistry, vol. 21, no. 27, pp. 5492-5505, 2023.
, “Carbon derived from soft pyrolysis of a covalent organic framework as a support for small-sized RuO2 showing exceptionally low overpotential for oxygen evolution reaction”, ACS Omega, vol. 4, no. 8, pp. 13465-13473, 2019.
, “Carbon derived from soft pyrolysis of a covalent organic framework as a support for small-sized RuO2 showing exceptionally low overpotential for oxygen evolution reaction”, ACS Omega, vol. 4, no. 8, pp. 13465-13473, 2019.
, “Carbonylation of glycerol with urea to glycerol carbonate over supported Zn catalysts”, Applied Petrochemical Research, vol. 7, no. 1, 2017.
, “Cardol: Cashew nut shell liquid (CNSL) - derived starting material for the preparation of partially bio-based epoxy resins”, European Polymer Journal, vol. 166, p. 111029, 2022.
, “Catalytic and DFT study of selective ethylene oligomerization by nickel(II) oxime-based complexes”, Journal of Molecular Catalysis A-Chemical, vol. 366, pp. 238-246, 2013.
, “Catalytic performances of silicotungstic acid/zirconia supported SBA-15 in an esterification of benzyl alcohol with acetic acid”, Journal of Molecular Catalysis A-Chemical , vol. 276 , no. 1-2, pp. 150-157, 2007.
, “Catalytic reductive deoxygenation of esters to ethers driven by hydrosilane activation through non-covalent interactions with a fluorinated borate salt”, Catalysis Science & Technology, vol. 10, no. 14, pp. 4586-4592, 2020.
, “CCCTK (Compute Cure for Cancer ToolKit) an open source drug discovery platform for design of novel anti-cancer agents”, in 255th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nexus of Food, Energy, and Water, New Orleans, LA, 2018.
, “Cell line development for biomanufacturing processes: recent advances and an outlook”, Biotechnology Letters, vol. 37, no. 8, pp. 1553-1564, 2015.
, “Cellulases from penicillium janthinellum mutants: solid-state production and their stability in ionic liquids”, Bioresources, vol. 4, no. 4, pp. 1670-1681, 2009.
, “Challenges associated with metal chelation therapy in alzheimer's disease”, Journal of Alzheimers Disease, vol. 17, no. 3, pp. 457-468, 2009.
, “Characteristics of precipitation pattern in the Arabian Peninsula and its variability associated with ENSO”, Arabian Journal of Geosciences, vol. 9, no. 3, p. 186, 2016.
, “Characterization of biocompatible NiCo2O4 nanoparticles for applications in hyperthermia and drug delivery”, Nanomedicine-Nanotechnology Biology and Medicine, vol. 8, no. 4, pp. 452-459, 2012.
, “Characterization of the structures and dynamics of phosphoric acid doped benzimidazole mixtures: a molecular dynamics study”, Journal of Molecular Modeling, vol. 19, no. 1, pp. 109-118, 2013.
, “Characterizing flow and solid suspension in optimax crystallization workstation”, in North American Mixing Forum 2016 - Core Programming Area at the 2016 AIChE Annual Meeting, San Francisco; United States, 2016.
, “ChemEngine: harvesting 3D chemical structures of supplementary data from PDF files”, Journal of Cheminformatics, vol. 8, p. Article Number: 73, 2016.
, “Chemical inhomogeneity and mixed-state ferromagnetism in diluted magnetic semiconductor Co : TiO2”, Chemistry of Materials, vol. 20, no. 4, pp. 1344-1352, 2008.
, “Chemical sensing in two dimensional porous covalent organic nanosheets”, Chemical Science, vol. 6, no. 7, pp. 3931-3939, 2015.
, “Chemical sensing in two dimensional porous covalent organic nanosheets”, Chemical Science, vol. 6, no. 7, pp. 3931-3939, 2015.
, “Chemical shielding of closed-shell molecules using extended coupled-cluster theory”, in International Conference on Recent Advances in Spectroscopy - Theoretical, Astrophysical and Experimental Perspectives, 233 Spring Street, New York, NY 10013, United States, 2010, pp. 111-121.
, “Chemistry, anti-diabetic activity and structural analysis of substituted dihydropyrimidine analogues”, Journal of Molecular Structure, vol. 1227, p. 129412, 2021.
, “Chemoinformatics approach for building molecular networks from marine organisms”, Combinatorial Chemistry & High Throughput Screening, vol. 18, no. 7, pp. 673-684, 2015.
, “Chemoinformatics approach for the design and screening of focused virtual libraries”, in Practical Chemoinformatics, India: Springer, 2014, pp. 93-131.
, “ChemScreener: a distributed computing tool for scaffold based virtual screening”, Combinatorial Chemistry & High Throughput Screening, vol. 18, no. 6, pp. 544-561, 2015.
, “Chiral aziridine ring opening: facile synthesis of (R)-modletine and (R)-phenoxybenzamine hydrochloride”, Tetrahedron Letters, vol. 56, no. 38, pp. 5269-5271, 2015.
, “Chiral aziridine ring opening: facile synthesis of (R)-modletine and (R)-phenoxybenzamine hydrochloride”, Tetrahedron Letters, vol. 56, no. 38, pp. 5269-5271, 2015.
, “Cholesterol depletion by methyl-beta-cyclodextrin augments tamoxifen induced cell death by enhancing its uptake in melanoma”, Molecular Cancer, vol. 13, p. Article No. 204, 2014.
, “Chromerid genomes reveal the evolutionary path from photosynthetic algae to obligate intracellular parasites”, Elife, vol. 4, p. Article Number: e06974, 2015.
, “Chronic systemic exposure to IL6 leads to deregulation of glycolysis and fat accumulation in the zebrafish liver”, Biochimica ET Biophysica Acta-Molecular and Cell Biology of Lipids, vol. 1866, no. 5, p. 158905, 2021.
, “Clay encapsulated Cu(OH)(x) promoted homocoupling of arylboronic acids: an efficient and eco-friendly protocol”, Applied Catalysis A-General, vol. 470, pp. 232-238, 2014.
, “Cloning, overexpression, crystallization and preliminary X-ray crystallographic analysis of a slow-processing mutant of penicillin G acylase from Kluyvera citrophila”, Acta Crystallographica Section F-Structural Biology and Crystallization Communications, vol. 69, no. 8, pp. 925-929, 2013.
, “CO oxidation on large high-index faceted Pd nanostructures”, Journal of Catalysis, vol. 337, pp. 138-144, 2016.
, “CO2 hydrogenation to formate by palladium nanoparticles supported on N-incorporated periodic mesoporous organosilica”, ACS Sustainable Chemistry & Engineering, vol. 8, no. 39, pp. 14765-14774, 2020.
, “CO2 Laser direct written MOF-based metal-decorated and heteroatom-doped porous graphene for flexible all-solid-state microsupercapacitor with extremely high cycling stability”, ACS Applied Materials & Interfaces, vol. 8, no. 46, pp. 31841-31848, 2016.
, “Cobalt nanoparticles doped emaraldine salt of polyaniline: a promising room temperature magnetic semiconductor”, Journal of Magnetism and Magnetic Materials, vol. 322, no. 24, pp. 3926-3931, 2010.
, “Cocrystal approach to modulate the photoluminescent properties of a GFP chromophore analogue: role of halogen/hydrogen bonding in achieving a wide range of solid-state fluorescence emissions”, Crystal Growth & Design, vol. 23, no. 7, pp. 5052-5065, 2023.
, “COF-supported zirconium oxyhydroxide as a versatile heterogeneous catalyst for Knoevenagel condensation and nerve agent hydrolysis”, iScience, vol. 26, no. 11, p. 108088, 2023.
, “COF-supported zirconium oxyhydroxide as a versatile heterogeneous catalyst for Knoevenagel condensation and nerve agent hydrolysis”, iScience, vol. 26, no. 11, p. 108088, 2023.
, “COLL 613-Studies on the vapor-phase photo-oxidation of methanol over nano-size titania clusters dispersed in MCM-41 mesoporous silica”, Abstracts of Papers of the American Chemical Society, vol. 232, p. 613-COLL, 2006.
, “Combined experimental and density functional theory study on the Pd-mediated cycloisomerization of o-alkynylnitrobenzenes - synthesis of isatogens and their evaluation as modulators of ROS-mediated cell death”, European Journal of Organic Chemistry, no. 31, pp. 5955-5966, 2010.
, “Comparative behavior of CdS and CdSe quantum dots in poly (3-hexylthiophene) based nanocomposites (vol 41, pg 198, 2006)”, Materials Research Bulletin, vol. 46, no. 8, p. 1321, 2011.
, “Comparative genomics of the apicomplexan parasites toxoplasma gondii and neospora caninum: coccidia differing in host range and transmission strategy”, Plos Pathogens, vol. 8, no. 3, 2012.
, “Comparative genomics of the pathogenic ciliate Ichthyophthirius multifiliis, its free-living relatives and a host species provide insights into adoption of a parasitic lifestyle and prospects for disease control”, Genome Biology, vol. 12, no. 10, p. Article Number: R100, 2011.
, “Comparative genomics of the pathogenic ciliate Ichthyophthirius multifiliis, its free-living relatives and a host species provide insights into adoption of a parasitic lifestyle and prospects for disease control”, Genome Biology, vol. 12, no. 10, p. Article Number: R100, 2011.
, “Comparative study of polycaprolactone electrospun fibers and casting films enriched with carbon and nitrogen sources and their potential use in water bioremediation”, Membranes, vol. 12, no. 3, p. 327, 2022.
, “Comparative study of polycaprolactone electrospun fibers and casting films enriched with carbon and nitrogen sources and their potential use in water bioremediation”, Membranes, vol. 12, no. 3, p. 327, 2022.
, “Comparative study on liquid phase alkylation of 2-methylnaphthalene with long chain olefins using different solid acid catalysts”, Applied Catalysis A-General, vol. 352, no. 1-2, pp. 74-80, 2009.
, “Comparison of feature selection and classification combinations for cancer classification using microarray data”, International Journal of Bioinformatics Research and Applications, vol. 5, no. 4, pp. 417-431 , 2009.
, “Comparison of methods for identifying periodically varying genes”, International Journal of Bioinformatics Research and Applications, vol. 9, no. 1, pp. 53-70, 2013.
, “On the competition between six-membered and five-membered NHC towards alane centered ring expansion”, Chemical Communications, vol. 59, no. 55, pp. 8540-8543, 2023.
, “Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of CO2- anion”, Journal of Chemical Physics, vol. 141, no. 16, p. Article No. 164113, 2014.
, “Complexation of heavy metals by crosslinked chitin and its deacetylated derivatives”, Carbohydrate Polymers, vol. 71, no. 1, pp. 66-73, 2008.
, “Comprehensive analysis of physiological and metabolomic responses to drought reveals specific modulation of acquired tolerance mechanisms in rice”, Physiologia Plantarum, vol. 175, no. 3, p. e13917, 2023.
, “Comprehensive molecular and clinical investigation of approved Anti-HCV drugs repurposing against SARS-CoV-2 infection: a glaring gap between benchside and bedside medicine”, Vaccines, vol. 11, no. 3, p. 515, 2023.
, “Comprehensive study on solomonamides: total synthesis, stereochemical revision, and SAR studies toward identification of simplified lead”, Journal of Organic Chemistry, vol. 88, no. 24, pp. 17088-17133, 2023.
, “Computational identification of most potent atom pair catalysts for electrocatalytic nitrogen reduction reaction over hydrogen evolution reaction”, Inter., vol. 58, pp. 1345-1358, 2024.
, “Computational insights into hydroboration with acyclic alpha-Borylamido-germylene and stannylene catalysts: Cooperative dual catalysis the key to system efficiency”, Polyhedron, vol. 222, p. 115907, 2022.
, “Computational insights into the iron-catalyze d magnesium-me diate d hydroformylation of alkynes”, Journal of Organometallic Chemistry, vol. 986, p. 122621, 2023.
, “Computational insights into the role of external and local electric fields in macrocyclic chemical and biological systems”, ChemPhysChem, vol. 22, no. 23, pp. 2484-2492, 2021.
, “Computational investigation of the role of the iridium dihydrogen pincer complex in the formation of the cyclic pentamer (NH2BH2)(5)”, Computational and Theoretical Chemistry, vol. 992, pp. 18-29, 2012.
, “Computational study of metal free alcohol dehydrogenation employing frustrated lewis pairs”, Journal of Organic Chemistry, vol. 80, no. 4, pp. 2081-2091, 2015.
, “Concise enantioselective synthesis of (+)-sertraline and (-)-CP-52002 using proline catalysis”, Tetrahedron Letters, vol. 57, no. 9, pp. 1053-1055, 2016.
, “Concise synthesis of (+/-)-clopidogrel via carboxylation of benzylamine with CO2”, Synthetic Communications, vol. 45, no. 18, pp. 2099-2105, 2015.
, “Concurrent display of both alpha- and beta-turns in a model peptide”, Organic & Biomolecular Chemistry, vol. 9, no. 16, pp. 5762-5765, 2011.
, “Conducting polyanilline based paints on hot dip galvanized low carbon steel for corrosion protection”, Bulgarian Chemical Communications, vol. 44, no. 4, pp. 318-323, 2012.
, “Conductive interface promoted bifunctional oxygen reduction/evolution activity in an ultra-low precious metal based hybrid catalyst (vol 57, pg 1951, 2021)”, Chemical Communications, vol. 57, no. 22, p. 2824, 2021.
, “Conductive interface promoted bifunctional oxygen reduction/evolution activity in an ultra-low precious metal based hybrid catalyst (vol 57, pg 1951, 2021)”, Chemical Communications, vol. 57, no. 22, p. 2824, 2021.
, “Conductive interface promoted bifunctional oxygen reduction/evolution activity in an ultra-low precious metal based hybrid catalyst”, Chemical Communications, vol. 57, no. 15, pp. 1951-1954, 2021.
, “Conductive interface promoted bifunctional oxygen reduction/evolution activity in an ultra-low precious metal based hybrid catalyst”, Chemical Communications, vol. 57, no. 15, pp. 1951-1954, 2021.
, “Confinement of zinc oxide nanoparticles in ordered mesoporous silica MCM-41”, Materials Chemistry and Physics, vol. 133, no. 2-3, pp. 850-856, 2012.
, “Conformational characterization of human eukaryotic initiation factor 2 alpha: a single tryptophan protein”, Biochemical and Biophysical Research Communications, vol. 390, no. 2, pp. 273-279, 2009.
, “Conformationally rigid aromatic amino acids as potential building blocks for abiotic foldamers”, Organic & Biomolecular Chemistry, vol. 9, no. 2, pp. 367-369, 2011.
, “Conserved RNA binding activity of phosphatidyl inositol 5-phosphate 4-kinase (PIP4K2A)”, Frontiers in Molecular Biosciences, vol. 8, p. 631281, 2021.
, “Constrained variational approach for energy derivatives in Intermediate hamiltonian fock-space coupled-cluster theory”, Chemical Physics, vol. 401, pp. 45-49, 2012.
, “Constrained variational response to Fock-space multi-reference coupled-cluster theory: Some pilot applications”, Journal of Molecular Structure-Theochem, vol. 768, no. 1-3, pp. 91-96, 2006.
, “Continuous phenol biodegradation in a simple packed bed bioreactor of calcium alginate-immobilized Candida tropicalis (NCIM 3556)”, World Journal of Microbiology & Biotechnology, vol. 26, no. 5, pp. 805-809, 2010.
, “Controlled exchange bias behavior of manganese nanoparticles”, Journal of Magnetism and Magnetic Materials, vol. 559, p. 169504, 2022.
, “Controlled reduction of isocyanates to formamides using monomeric magnesium”, Chemical Communications, vol. 59, no. 16, pp. 2255-2258, 2023.
, “Convenient route for Au@Ti-SiO2 nanocatalyst synthesis and its application for room temperature CO oxidation”, Journal of Physical Chemistry C, vol. 121, no. 9, pp. 4946-4957, 2017.
, “Convergent covalent organic framework thin sheets as flexible supercapacitor electrodes”, ACS Applied Material & Interfaces, vol. 10, no. 33, pp. 28139-28146, 2018.
, “Coordination flexibility aided CO2-specific gating in an iron isonicotinate MOF”, Chemistry-an Asian Journal, vol. 17, no. 4, p. e202101305, 2022.
, “Coordination flexibility aided CO2-specific gating in an iron isonicotinate MOF”, Chemistry-an Asian Journal, vol. 17, no. 4, p. e202101305, 2022.
, “Copper- and ligand-free sonogashira reaction catalyzed by Pd(0) nanoparticles at ambient conditions under ultrasound irradiation”, Journal of Organic Chemistry, vol. 70, no. 12, pp. 4869-4872, 2005.
, “Copper-catalyzed regioselective C-H alkylation of phenol derivatives with unactivated alkyl chlorides: manifesting a Cu(I)/Cu(III) pathway”, Journal of Catalysis , vol. 430, 2024.
, “Core-shell nanoparticles: synthesis and applications in catalysis and electrocatalysis”, Chemical Society Reviews, vol. 44, no. 21, pp. 7540-7590, 2015.
, “Correlating the role of hydrophilic/hydrophobic nature of Rh(I) and Ru(II) supported organosilica/silica catalysts in organotransformation reactions”, Applied Catalysis A-General, vol. 513, pp. 138-146, 2016.
, “Correlation trends in the magnetic hyperfine structure of atoms: a relativistic coupled-cluster case study”, Physical Review A, vol. 98, no. 2, 2018.
, “Coupled cluster methods for autoionisation resonances”, International Reviews in Physical Chemistry, vol. 33, no. 3, pp. 397-425, 2014.
, “Coupling growth-factor engineering with nanotechnology for therapeutic angiogenesis”, Proceedings of the National Academy of Sciences of the United States of America, vol. 107, no. 31, pp. 13608-13613, 2010.
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