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D
M. Kumar Bisai, Swamy, V. S. V. S. N., K. Raj, V., Vanka, K., and Sen, S. S., “Diverse reactivity of hypersilylsilylene with boranes and threecomponent reactions with aldehyde and HBpin”, Inorganic Chemistry, vol. 60, no. 3, pp. 1654-1663, 2021.
G. Kundu, Ajithkumar, V. S., Bisai, M. Kumar, Tothadi, S., Das, T., Vanka, K., and Sen, S. S., “Diverse reactivity of carbenes and silylenes towards fluoropyridines”, Chemical Communications, vol. 57, no. 36, pp. 4428-4431, 2021.
V. T. Humne, Ghom, M. H., Naykode, M. S., Dangat, Y., Vanka, K., and Lokhande, P., “Direct oxidation of bromo-derived Fischer-Borsche oxo-ring using molecular iodine with combined experimental and computational study”, Organic & Biomolecular Chemistry, vol. 20, no. 29, pp. 5726-5729, 2022.
N. R. Kakde, Bharathkumar, H. J., Wavhal, B. A., Nikam, A., Patil, S., Dash, S. Ranjan, Vanka, K., Krishnamoorthy, K., Kulkarni, A., and Asha, S. K., “Direct (hetero)arylation (DHAP) polymerization of conjugated polymers - new A-B-A monomer design for P(NDI2OD-T2) & the challenges of adopting DHAP for continuous flow processes”, Journal of Materials Chemistry C, vol. 10, no. 36, pp. 13025-13039, 2022.
V. Gupta, Sahu, D., Jain, S., Vanka, K., and Singh, R. P., “Diastereoselective multi-component tandem condensation: synthesis of 2-amino-4-(2-furanone)-4H-chromene-3-carbonitriles”, Organic & Biomolecular Chemistry, vol. 17, no. 39, pp. 8853-8857, 2019.
K. Vanka, Singh, G., Iyer, D., and Gupta, V. K., “DFT Study of lewis base interactions with the MgCl2 surface in the ziegler-natta catalytic system: expanding the role of the donors”, Journal of Physical Chemistry C, vol. 114, no. 37, pp. 15771-15781, 2010.
A. Pal and Vanka, K., “DFT investigation of the potential of porous cages for the catalysis of ammonia borane dehydrogenation”, Chemical Communications, vol. 47, no. 41, pp. 11417-11419, 2011.
R. Kumar, Bisai, M. Kumar, Jain, S., Vanka, K., and Sen, S. S., “Deoxygenative hydroboration of primary and secondary amides: a catalyst-free and solvent-free approach”, Chemical Communications, vol. 57, no. 81, pp. 10596-10599, 2021.
A. Halder, Kandambeth, S., Biswal, B. P., Kaur, G., Roy, N. Chaki, Addicoat, M. A., Salunke, J. K., Banerjee, S., Vanka, K., Heine, T., Verma, S., and Banerjee, R., “Decoding the morphological diversity in two dimensional crystalline porous polymers by core planarity modulation”, Angewandte Chemie - International Edition, vol. 55, no. 27, pp. 7806-7810, 2016.
V. U. Bhaskar Rao, Kumar, K., Das, T., and Vanka, K., “DBU-mediated diastereoselective aldol-type cyanomethylation of isatins”, Journal of Organic Chemistry, vol. 82, no. 8, pp. 4489-4496, 2017.
C
R. Kumar, Sharma, V., Banerjee, S., Vanka, K., and Sen, S. S., “Controlled reduction of isocyanates to formamides using monomeric magnesium”, Chemical Communications, vol. 59, no. 16, pp. 2255-2258, 2023.
M. V. Mane, Rizvi, M. A., and Vanka, K., “Computational study of metal free alcohol dehydrogenation employing frustrated lewis pairs”, Journal of Organic Chemistry, vol. 80, no. 4, pp. 2081-2091, 2015.
K. Ghatak and Vanka, K., “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.
A. Mukherjee, Ghule, S., and Vanka, K., “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.
H. Sharma, Tewari, T., Chikkali, S. H., and Vanka, K., “Computational insights into the iron-catalyze d magnesium-me diate d hydroformylation of alkynes”, Journal of Organometallic Chemistry, vol. 986, p. 122621, 2023.
S. Banerjee and Vanka, K., “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.
K. Balayan, Sharma, H., Vanka, K., Ravindranathan, S., Gonnade, R. G., and Sen, S. S., “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.
C. V. Ramana, Patel, P., Vanka, K., Miao, B., and Degterev, A., “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.
B. P. Mali, Dash, S. Ranjan, Annadhasan, M., Biswas, A., Manoj, K., Vanka, K., and Gonnade, R. G., “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.
V. Rysak, Dixit, R., Trivelli, X., Merle, N., Agbossou-Niedercorn, F., Vanka, K., and Michon, C., “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.
K. N. Tayade, Mane, M. V., Sen, S., Murthy, C. N., Tembe, G. L., S. Pillai, M., Vanka, K., and Mukherjee, S., “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.
S. Jain and Vanka, K., “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.
N. Kuriakose and Vanka, K., “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.
A. Pal and Vanka, K., “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.
N. Kuriakose and Vanka, K., “Can molecular cages be effective at small molecule activation? a computational investigation”, Inorganic Chemistry, vol. 52, no. 8, pp. 4238-4243, 2013.
N. Kuriakose and Vanka, K., “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.
B
S. Yadav, Dixit, R., Vanka, K., and Sen, S. S., “Beyond hydrofunctionalisation: a well-defined calcium compound catalysed mild and efficient carbonyl cyanosilylation”, Chemistry-A European Journal, vol. 24, no. 6, pp. 1269-1273, 2018.
S. Banerjee and Vanka, K., “B(C6F5)(3): catalyst or initiator? insights from computational studies into surrogate silicon chemistry”, ACS Catalysis, vol. 8, no. 7, pp. 6163-6176, 2018.
A
P. N. Bagle, Mane, M. V., Vanka, K., Shinde, D. R., Shaikh, S. R., Gonnade, R. G., and Patil, N. T., “Au(I)/Ag(I) co-operative catalysis: interception of Ag-bound carbocations with α-gold(I) enals in the imino-alkyne cyclizations with N-allenamides”, Chemical Communications, vol. 52, pp. 14462-14465, 2016.
V. S. Shende, Shingote, S. K., Deshpande, S. H., Kuriakose, N., Vanka, K., and Kelkar, A. A., “Asymmetric transfer hydrogenation of imines in water/methanol co-solvent system and mechanistic investigation by DFT study”, RSC Advances, vol. 4, no. 86, pp. 46351-46356, 2014.
S. Dey, Das, S., Patel, A., K. Raj, V., Vanka, K., and Manna, D., “Antimicrobial two-dimensional covalent organic nanosheets (2D-CONs) for the fast and highly efficient capture and recovery of phosphate ions from water”, Journal of Materials Chemistry A, vol. 10, no. 9, pp. 4585-4593, 2022.
S. Yadav, Kumar, R., K. Raj, V., Yadav, P., Vanka, K., and Sen, S. S., “Amidinato germylene-zinc complexes: synthesis, bonding, and reactivity”, Chemistry-An Asian Journal, vol. 15, no. 19, pp. 3116-3121, 2020.
R. L. Gawade, Chakravarty, D. K., Kotmale, A., Sangtani, E., Joshi, P. V., Ahmed, A., Mane, M. V., Das, S., Vanka, K., Rajamohanan, P. R., Puranik, V. G., and Gonnade, R. G., “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.
K. Gour, Pramanik, D., Dash, S. Ranjan, Tothadi, S., Vanka, K., and Sen, S. S., “Activation of the olefinic C-H bond of NHC and NHO by perimidine-based silicon and germanium compounds”, Organometallics, vol. 42, no. 15, pp. 1909-1917, 2023.
S. Kadam and Vanka, K., “Accounting of noise to solve the problem of negative populations in approximate accelerated stochastic simulations”, RSC Advances, vol. 4, no. 102, pp. 58127-58136, 2014.
S. Pahar, Karak, S., Pait, M., K. Raj, V., Vanka, K., and Sen, S. S., “Access to silicon(II)- and germanium(II)-indium compounds”, Organometallics, vol. 37, no. 7, pp. 1206-1213, 2018.
S. Pahar, Swamy, V. S. V. S. N., Das, T., Gonnade, R. G., Vanka, K., and Sen, S. S., “Access to diverse germylenes and a six-membered dialane with a flexible beta-diketiminate”, Chemical Communications, vol. 56, no. 79, pp. 11871-11874, 2020.
1
M. K. Munshi, Gade, S. M., Mane, M. V., Mishra, D., Pal, S., Vanka, K., Rane, V. H., and Kelkar, A. A., “1,8-Diazabicyclo[5.4.0]undec-7-ene (DBU): a highly efficient catalyst in glycerol carbonate synthesis”, Journal of Molecular Catalysis A-Chemical, vol. 391, pp. 144-149, 2014.
M. Nirshad Alam, Dash, S. Ranjan, Mukherjee, A., Pandole, S., Marelli, U. Kiran, Vanka, K., and Maity, P., “[1,3]-Claisen rearrangement via removable functional group mediated radical stabilization”, Organic Letters, vol. 23, no. 3, pp. 890-895, 2021.

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