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“Identification of Th1/Th2 regulatory switch to promote healing response during Leishmaniasis: a computational approach”, EURASIP Journal on Bioinformatics and Systems Biology, vol. 1, 2015.
, “Temporal protein expression pattern in intracellular signalling cascade during T-cell activation: a computational study”, Journal of Biosciences, vol. 40, no. 4, pp. 769-789, 2015.
, “Incorporation of zirconium in medium-pore aluminophosphate molecular sieves with AEL framework”, Microporous and Mesoporous Materials, vol. 108, no. 1-3, pp. 223-229, 2008.
, “ Exploring immuno-regulatory mechanisms in the tumor microenvironment: model and design of protocols for cancer remission”, Plos One, vol. 13, no. 9, 2018.
, “Atomic sizes from atomic interactions”, Journal of Molecular Structure, vol. 930, no. 1-3, pp. 162-166, 2009.
, “Azide-functionalized lanthanide-based metal-organic frameworks showing selective CO2 gas adsorption and postsynthetic cavity expansion”, Inorganic Chemistry, vol. 52, no. 7, pp. 3588-3590, 2013.
, “Atomic sizes and atomic properties”, Journal of Physics B-Atomic Molecular and Optical Physics, vol. 41, no. 10, p. 105002, 2008.
, “Molecular geometry from molecular tensegrity: a case study of gas-phase MX2 compounds”, Current Science, vol. 90, no. 9, pp. 1251-1253, 2006.
, “Long-range synthon aufbau modules (LSAM) in crystal structures: systematic changes in C6H6-nFn (0 <= n <= 6) fluorobenzenes”, Crystengcomm, vol. 12, no. 3, pp. 817-833, 2010.
, “Van der waals and polar intermolecular contact distances: quantifying supramolecular synthons”, Chemistry-an Asian Journal, vol. 3, no. 5, pp. 868-880, 2008.
, “Bond length variations: electron number profiles and transferable atomic sizes”, Journal of Molecular Structure, vol. 936, no. 1-3, pp. 1-8, 2009.
, “Molecular tensegrity: predicting 1,3-X–-X distance in gas-phase MXn (n <= 4) compounds from atomic sizes”, Current Science, vol. 91, no. 11, pp. 1505-1508, 2006.
, “Synthesis and characterization of bile acid-based poly beta amino esters for paclitaxel delivery”, Journal of Applied Polymer Science, vol. 122, no. 1, pp. 220-232, 2011.
, “Understanding unfolding and refolding of the antibody fragment (Fab). I. In-vitro study”, Biochemical Engineering Journal, vol. 164, p. 107764, 2020.
, “Understanding unfolding and refolding of the antibody fragment (Fab) III: mapping covalent and non-covalent interactions during in-vitro refolding of light chain, heavy chain, and Fab.”, Biochemical Engineering Journal, vol. 187, p. 108644, 2022.
, “Novel mechanism involved in temporal regulation of skin pigmentation homeostasis”, Journal of Investigative Dermatology, vol. 132, p. S128, 2012.
, “Numerical and experimental studies on extrudate swell of branched polyethylene through axisymmetric and planar dies”, Journal of Polymer Engineering, vol. 31, no. 2-3, pp. 217-221, 2011.
, “Prediction of extrudate swell in polymer melt extrusion using an Arbitrary Lagrangian Eulerian (ALE) based finite element method”, Journal of Non-Newtonian Fluid Mechanics, vol. 156, no. 1-2, pp. 21-28, 2009.
, “Simulation of viscoelastic flows of polymer solutions in abrupt contractions using an arbitrary lagrangian eulerian (ALE) based finite element method”, Journal of Non-Newtonian Fluid Mechanics, vol. 143, no. 2-3, pp. 157-169, 2007.
, “Extrudate swell of linear and branched polyethylenes: ALE simulations and comparison with experiments”, Journal of Non-Newtonian Fluid Mechanics, vol. 166, no. 1-2, pp. 12-24, 2011.
, “Silencing an N-acyltransferase-like involved in lignin biosynthesis in nicotiana attenuata dramatically alters herbivory-induced phenolamide metabolism”, Plos One, vol. 8, no. 5, p. e62336, 2013.
, “Pd-catalyzed regioselective mono-arylation: quinazolinone as the inherent directing group for C(sp(2))-H activation”, Journal of Organic Chemistry, vol. 82, no. 12, pp. 6366-6372, 2017.
, “Pd(II)-catalyzed intramolecular tandem olefin amidation/C-H activation protocol for the syntheses of the protoberberine class of natural products”, Organic Letters, vol. 18, no. 15, pp. 3862-3865, 2016.
, “Radical-mediated dehydrative preparation of cyclic imides using (NH4)(2)S2O8-DMSO: application to the synthesis of vernakalant”, Beilstein Journal of Organic Chemistry, vol. 11, pp. 1008-1016, 2015.
, “Diversification of quinazolinones by Pd-catalyzed C(sp(3))-acetoxylation”, Journal of Organic Chemistry, vol. 82, no. 19, pp. 10470-10478, 2017.
, “Ru-catalyzed regioselective cascade annulation of acrylamides with 2-alkynoates for the synthesis of various 6-Oxo nicotinic acid esters”, Journal of Organic Chemistry, vol. 84, no. 4, pp. 1863-1870, 2019.
, “Structure-activity studies of dodecatungstophosphoric acid impregnated bentonite clay catalyst in hydroxyalkylation of p-cresol”, Catalysis Communications, vol. 11, no. 11, pp. 942-945, 2010.
, “Acidity tuning of montmorillonite K10 by impregnation with dodecatungstophosphoric acid and hydroxyalkylation of phenol”, Applied Clay Science, vol. 48, no. 1-2, pp. 164-170, 2010.
, “Hydroxyalkylation of p-Cresol to 2,2 `-methylenebis(4-methylphenol) using Sn/Si-MCM-41 catalysts”, Chemistry Letters, vol. 39, no. 2, pp. 126-127, 2010.
, “Selective hydroxyalkylation of phenol to bisphenol F over dodecatungstophosphoric acid (DTP) impregnated on fumed silica”, Applied Catalysis A-General, vol. 354, no. 1-2, pp. 176-182, 2009.
, “Effect of SnO2/Al2O3 ratio of Si-based MFI on its acidity and hydrophobicity: application in selective hydroxyalkylation of p-cresol”, Catalysis Communications, vol. 44, pp. 29-34, 2014.
, “Efficient gamma-Fe2O3 catalyst for liquid phase air oxidation of p-hydroxybenzyl alcohol under mild conditions”, Catalysis Communications, vol. 10, no. 5, pp. 485-489, 2009.
, “Montmorillonite for selective hydroxyalkylation of p-cresol”, Applied Clay Science, vol. 43, no. 1, pp. 113-117, 2009.
, “Liquid phase oxidation of p-vanillyl alcohol over synthetic Co-saponite catalyst”, Applied Clay Science, vol. 53, no. 2, pp. 157-163, 2011.
, “Continuous hydroxyalkylation of p-Cresol to 2,2 `-methylenebis(4-Methylphenol) in a fixed bed reactor”, Journal of Chemical Engineering of Japan, vol. 42, no. 10, pp. 782-787, 2009.
, “Photochromic metal organic frameworks for inkless and erasable printing”, Acta Crystallographica A‐Foundation and Advances, vol. 70, p. C110, 2014.
, “Self-exfoliated metal-organic nanosheets through hydrolytic unfolding of metal-organic polyhedra”, Chemistry-A European Journal, vol. 23, no. 30, pp. 7361-7366, 2016.
, “Photochromic metal-organic frameworks for inkless and erasable printing”, Chemical Science, vol. 7, no. 3, pp. 2195-2200, 2016.
, “Effect of method of preparation on hydrodesulphurization activity of Co- or Ni-promoted MoS2/SBA-15 catalysts”, Journal of Chemical Sciences, vol. 126, no. 2, pp. 437-444, 2014.
, “Clickable polyurethanes based on s- triazine ring containing aromatic diisocyanate bearing pendent alkyne group: synthesis and postmodification”, Journal of Polymer Science Part A Polymer Chemistry, vol. 55, no. 6, pp. 1008-1020, 2017.
, “Single-step insertion of M-Nx moieties in commercial carbon for sustainable bifunctional electrocatalysis: mapping insertion capacity, mass loss, and carbon reconstruction”, Carbon, vol. 196, pp. 1001-1011, 2022.
, “Nanocrystalline Ag3PO4 for sunlight- and ambient air-driven oxidation of amines: high photocatalytic efficiency and a facile catalyst regeneration strategy”, ACS Applied Materials & Interfaces, vol. 12, no. 26, pp. 29324-29334, 2020.
, “Targeted quantification of the glycated peptides of human serum albumin”, in Methods in Molecular Biology , 2017, pp. 403-416.
, “1H, 13C and 15N NMR assignments of two plant protease inhibitors (IRD7 and IRD12) from the plant capsicum annuum.”, Biomolecular NMR Assignments, vol. 13, no. 1, pp. 31-35, 2018.
, “NMR structure and dynamics of inhibitory repeat domain variant 12, a plant protease inhibitor from Capsicum annuum, and its structural relationship to other plant protease inhibitors”, Journal of Biomolecular Structure & Dynamics, 2019.
, “Synthesis of 3-Thia-1-dethiacephems via Regioselective Iodocyclization Reaction”, Synthesis-Stuttgart, vol. 47, no. 24, pp. 3956-3962, 2015.
, “First iodocyclization reaction of allene-thioureas: an efficient approach to bicyclic beta-lactams”, Tetrahedron Letters, vol. 55, no. 43, pp. 5998-6000, 2014.
, “Regioselective and diastereoselective iodocyclization reaction of alkene-thioureas: an efficient approach to bicyclic beta-lactams”, New Journal of Chemistry, vol. 39, no. 12, pp. 9422-9428, 2015.
, “Oviposition and feeding behaviour of Xanthopimpla pedator (Fabricius) (Hymenoptera: Ichneumonidae) on tropical tasar silkworm, Antheraea mylitta (Drury) (Lepidoptera: Saturniidae)”, Journal of Asia-Pacific Entomology, vol. 20, no. 3, pp. 977-983, 2017.
, “Biology and development of xanthopimpla pedator (hymenoptera: ichneumonidae): pupal endoparasitoid of antheraea mylitta (Lepidoptera: Saturniidae)”, Annals of the Entomological Society of America, vol. 110, no. 6, pp. 544-550, 2017.
, “Machine learning classifiers aid virtual screening for efficient design of mini-protein therapeutics”, Bioorganic & Medicinal Chemistry Letters, vol. 38, p. 127852, 2021.
, “Assessing therapeutic potential of molecules: molecular property diagnostic suite for tuberculosis”, Journal of Chemical Sciences, vol. 129, no. 5, pp. 515-531, 2017.
, “Reversible phase transformation phenomenon in titanium dioxide films: evidence beyond interface-nucleation and dissolution-precipitation kinetics”, Acta Materialia, vol. 146, pp. 253-264, 2018.
, “In situ study of radiation stability and associated conduction mechanisms of Nb-Doped TiO2/p-Si heterojunction diode under swift heavy ion irradiation”, IEEE Transactions on Electron Devices, vol. 66, no. 3, pp. 1475-1481, 2019.
, “Additive mediated syn-anti conformational tuning at nucleation to capture elusive polymorphs: remarkable role of extended pi-stacking interactions in driving the self-assembly”, Crystal Growth & Design, vol. 16, no. 4, pp. 2416-2428, 2016.
, “Comparative study of dG affinity vs. DNA methylation modulating properties of side chain derivatives of procainamide: insight into its DNA hypomethylating effect”, RSC Advances, vol. 6, no. 7, pp. 5350-5358, 2016.
, “Design, synthesis, docking studies and biological screening of 2-thiazolyl substituted-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazines as potent HIV-1 reverse transcriptase inhibitors”, European Journal of Medicinal Chemistry, vol. 157, pp. 310-319, 2018.
, “Uncatalyzed synthesis of thiomorpholide using polyethylene glycol as green reaction media”, Green Chemistry Letters and Reviews, vol. 3, no. 4, pp. 315-318, 2010.
, “Core-shell nanoparticles: synthesis and applications in catalysis and electrocatalysis”, Chemical Society Reviews, vol. 44, no. 21, pp. 7540-7590, 2015.
, “Chemodialysis of organic acids using ABPBI-based hollow fiber membranes”, Journal of Membrane Science, vol. 689, p. 122153, 2024.
, “Evaluation of n-type ternary metal oxide NiMn2O4 nanomaterial for humidity sensing”, Sensors and Actuators B-Chemical, vol. 191, pp. 837-843, 2014.
, “Hexaphosphate-derived phosphorus-functionalized carbon for lithium-ion battery anode”, Chemistryselect, vol. 2, no. 20, pp. 5600-5607, 2017.
, “3D Polyaniline architecture by concurrent inorganic and organic acid doping for superior and robust high rate supercapacitor performance”, Scientific Reports, vol. 6, p. Article No. 21002, 2016.
, “Influence of starting precursors and synthesis methods on the physiochemical properties of zirconia”, Materials Research Bulletin, vol. 55, pp. 8-12, 2014.
, “Hydrothermal synthesis of MCM-41 using differently manufactured amorphous dioxosilicon sources”, Materials Letters, vol. 60, no. 7, pp. 957-961, 2006.
, “Textural/structural, stability and morphological properties of mesostructured silicas (MCM-41 and MCM-48) prepared using different silica sources”, Catalysis Communications, vol. 6, no. 5, pp. 361-366, 2005.
, “Employing arynes for the generation of aryl anion equivalents and subsequent reaction with aldehydes”, Journal of Organic Chemistry, vol. 83, no. 18, pp. 11333-11340, 2018.
, “Influence of cultivar, ripeness, blanching, drying, irradiation, and pectin recovery on alk(en)ylresorcinols in mango peels”, European Food Research and Technology, vol. 240, no. 6, pp. 1235-1245, 2015.
, “N-Heterocyclic carbene-catalyzed synthesis of alpha-trifluoromethyl esters”, Organic Letters, vol. 20, no. 13, pp. 3897-3901, 2018.
, “Short enantioselective synthesis of (-)-bestatin via L-proline-catalyzed alpha-amination of an aldehyde”, Tetrahedron Letters, vol. 49, no. 48, pp. 6791-6793, 2008.
, “Short enantioselective synthesis of (-)-chloramphenicol and (+)-thiamphenicol using tethered aminohydroxylation”, Tetrahedron, vol. 62, no. 43, pp. 10202-10207, 2006.
, “NaIO4-mediated asymmetric bromohydroxylation of alpha,beta-unsaturated carboxamides with high diastereoselectivity: a short route to (-)-cytoxazone and droxidopa”, Tetrahedron Letter, vol. 48, no. 8, pp. 1375-1378, 2007.
, “Facile, environmentally benign and scalable approach to produce pristine few layers graphene suitable for preparing biocompatible polymer nanocomposites”, Scientific Reports, vol. 8, p. 11228, 2018.
, “Understanding the electron transfer process in ZnO-naphthol azobenzoic acid composites from photophysical characterisation”, Physical Chemistry Chemical Physics, vol. 18, no. 32, pp. 22179-22187, 2016.
, “Finite size effects on the structural and magnetic properties of sol-gel synthesized NiFe2O4 powders”, Journal of Magnetism and Magnetic Materials, vol. 302, no. 1, pp. 190-195, 2006.
, “Short enantioselective synthesis of guggultetrol, a naturally occurring lipid”, Tetrahedron-Asymmetry, vol. 21, no. 5, pp. 558-561, 2010.
, “Surface site modulations by conjugated organic molecules to enhance visible light activity of ZnO nanostructures in photocatalytic water splitting”, Journal of Physical Chemistry C, vol. 119, no. 6, pp. 3060-3067, 2015.
, “Drug-drug cocrystals of anticancer drugs erlotinib-furosemide and gefitinib-mefenamic acid for alternative multi-drug treatment”, Crystengcomm, vol. 22, no. 37, pp. 6137-6151, 2020.
, “Terminal uridylyl transferase mediated site-directed access to clickable chromatin employing CRISPR-dCas9”, Journal of the American Chemical Society, vol. 142, no. 32, pp. 13954-13965, 2020.
, “Sensitizing with short conjugated molecules: multimodal anchoring on ZnO nanoparticles for enhanced electron transfer characteristics, stability and H-2 evolution”, Catalysis Today, vol. 309, pp. 89-97, 2018.
, “Thermally conductive thin films derived from defect free graphene-natural rubber latex nanocomposite: preparation and properties”, Carbon, vol. 119, pp. 527-534, 2017.
, “Vanadium-containing ordered mesoporous silicas: synthesis, characterization and catalytic activity in the hydroxylation of biphenyl”, Applied Catalysis A - General, vol. 290, no. 1-2, pp. 148-158, 2005.
, “Efficient organocatalytic route to the atorvastatin side-chain”, Tetrahedron Letter, vol. 48, no. 48, pp. 8544-8546, 2007.
, “Enantioselective synthesis of tarchonanthuslactone using proline-catalyzed asymmetric alpha-aminooxylation”, Tetrahedron-Asymmetry, vol. 18, no. 8, pp. 975-981, 2007.
, “Crystal structure of a 1:1 co-crystal of the anti-cancer drug gefitinib with azelaic acid ”, Acta Crystallographica Section E: Crystallographic Communications, vol. 76, no. 6, pp. 884-888, 2020.
, “Finite size effects on the electrical properties of sol-gel synthesized CoFe2O4 powders: deviation from Maxwell-Wagner theory and evidence of surface polarization effects”, Journal of Physics D-Applied Physics, vol. 40, no. 6, pp. 1593-1602, 2007.
, “Kinetic studies on an algal biofilm reactor for raw sewage water treatment”, Chemical Engineering & Technology, vol. 39, no. 9, pp. 1629-1635, 2016.
, “Pd loaded bismuth ferrite: a versatile perovskite for dual applications as acetone gas sensor and photocatalytic dye degradation of malachite green”, Ceramics International, vol. 49, no. 4, pp. 5738-5747, 2023.
, “Sponge microflowers of NiCo2O4: a versatile material for high performance supercapacitor”, Journal of Porous Materials, vol. 29, no. 4, pp. 1239-1252, 2022.
, “Study of growth kinetics of Fe3Se4 nanocrystallites and the influence of size and shape tunability on their magnetic properties”, Journal of Physical Chemistry C , vol. 125, no. 14, pp. 7932-7943, 2021.
, “Study of the phase-evolution mechanism of an Fe-Se system at the nanoscale: optimization of synthesis conditions for the isolation of pure phases and their controlled growth”, Langmuir, vol. 36, no. 8, pp. 2012-2022, 2020.
, “Remarkable effect of Fe and Se composition on magnetic properties-comparative study of the Fe-Se system at the nanoscale”, Journal of Physical Chemistry C, vol. 126, no. 9, pp. 4655-4663, 2022.
, “Catalytic dehydration of lactic acid to acrylic acid using calcium hydroxyapatite catalysts”, Green Chemistry, vol. 15, no. 5, pp. 1211-1217, 2013.
, “Nonstoichiometric calcium pyrophosphate: a highly efficient and selective catalyst for dehydration of lactic acid to acrylic acid”, RSC Advances, vol. 4, no. 63, pp. 33319-33326, 2014.
, “Synthesis and thermal properties of soluble silicon containing phenylated aromatic-aliphatic polyamides”, Journal of Thermal Analysis and Calorimetry, vol. 98, no. 2, pp. 539-545, 2009.
, “High-throughput metabolomic and transcriptomic analyses vet the potential route of cerpegin biosynthesis in two varieties of Ceropegia bulbosa Roxb.”, Planta, vol. 251, no. 1, p. 28, 2020.
, “Bacterial communities and diversity of western ghats soil: a study of a biodiversity hotspot”, Current Microbiology, vol. 80, no. 4, p. 108, 2023.
, “Metal or nonmetal cooperation with a phenyl group: route to catalysis? a computational investigation”, ACS Catalysis, vol. 3, no. 5, pp. 920-927, 2013.
, “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 investigation on the catalytic activity of Rh-6 and Rh4Ru2 clusters towards methanol activation”, Theoretical Chemistry Accounts , vol. 134, no. 1, p. 1597, 2014.
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