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Journal Article
S. Banerjee and Vanka, K., "Weak" C-H•••S interaction drives enantioselectivity in cinchona alkaloid complex catalyzed thiocyanation, Chemistry-An Asian Journal, vol. 18, no. 14, p. e202300321, 2023.
G. Fischer, Goursot, A., Coq, B., Delahay, G., and Pal, S., Theoretical study of N2O reduction by CO in Fe-BEA zeolite, Chemphyschem, vol. 7, no. 8, pp. 1795-1801, 2006.
S. K. Pandey, Jogdand, G. F., Oliveira, J. C. A., Mata, R. A., Rajamohanan, P. R., and Ramana, C. V., Synthesis and structural characterization of homochiral homo-oligomers of parent CIS- and trans-furanoid-beta-amino acids, Chemistry-A European Journal, vol. 17, no. 46, pp. 12946-12954, 2011.
G. Kundu, De, S., Tothadi, S., Das, A., Koley, D., and Sen, S. S., Saturated N-heterocyclic carbene based thiele's hydrocarbon with a tetrafluorophenylene linker, Chemistry-A European Journal, 2019.
J. Kumawat, Gupta, V. Kumar, and Vanka, K., Nature of the active site in ziegler-natta olefin polymerization catalysis systems - a computational investigation, European Journal of Inorganic Chemistry, no. 29, pp. 5063-5076, 2014.
C. Sekhar Rout, Khare, R. T., Kashid, R. V., Joag, D. S., More, M. A., Lanzillo, N. A., Washington, M., Nayak, S. K., and Late, D. J., Metallic few-layer flowerlike VS2 nanosheets as field emitters, European Journal of Inorganic Chemistry, no. 31, pp. 5331-5336, 2014.
D. Manzoor and Pal, S., Enhanced interaction of molecular oxygen with amino acid complexes of silver and gold clusters, Indian Journal of Chemistry Section A-Inorganic Bio-Inorganic Physical Theoretical & Analytical Chemistry, vol. 53, no. 8-9, pp. 996-1000, 2014.
K. Srinivas, Dangat, Y., Kommagalla, Y., Vanka, K., and Ramana, C. V., Electronic control on linear versus branched alkylation of 2-/3-aroylbenzofurans with acrylates: combined DFT and synthetic studies, Chemistry-A European Journal, vol. 23, no. 31, pp. 7570-7581, 2017.
J. Kumawat, Gupta, V. Kumar, and Vanka, K., Effect of donors on the activation mechanism in ziegler-natta catalysis: a computational study, Chemcatchem, vol. 8, no. 10, pp. 1809-1818, 2016.
T. Kelkar, Pal, S., and Kanhere, D. G., Density functional investigations of electronics structure and dehydrogenation reactions of Al- and Si-substituted magnesium hydride, ChemPhysChem , vol. 9, no. 6, pp. 928-934, 2008.
A. Halder and Banerjee, R., Decoding the morphological diversity in two dimensional crystalline porous polymers, Acta Crystallographica A‐Foundation and Advances, vol. 70, p. C552, 2014.
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.
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.
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. Kar, Sarkar, B., Ghumaan, S., Janardanan, D., van Slageren, J., Fiedler, J., Puranik, V. G., Sunoj, R. B., Kaim, W., and Lahiri, G. Kumar, 2,5-dioxido-1,4-benzoquinonediimine (H2L2-), a hydrogen-bonding noninnocent bridging ligand related to aminated topaquinone: different oxidation state distributions in complexes [(bpy)(2)Ru(2)(mu-H2L)](n) (n=0,+,2+,3+,4+) and [(acac)(2)Ru(2)(mu-H2L)], Chemistry - a European Journal, vol. 11, no. 17, pp. 4901-4911, 2005.