Density functional study on the binding properties of nucleobases to stanane nanosheet von Keerthi Bhavadharani, R., Nagarajan, V., Chandiramouli, R.

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Interaction studies of volatiles from jackfruit on α-phosphorene nanosheet—a DFT outlook von Nagarajan, V., Bhavadharani, R. Keerthi, Chandiramouli, R.

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Silicene nanosheet to discriminate the quality of pear fruit based on volatiles adsorption — a DFT application von Bhavadharani, R Keerthi, Nagarajan, V, Chandiramouli, R

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Silicene nanosheet to discriminate the quality of pear fruit based on volatiles adsorption --- a DFT application von Bhavadharani, R Keerthi, Nagarajan, V, Chandiramouli, R

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Investigation on graphdiyne nanosheet in adsorption of sorafenib and regorafenib drugs: A DFT approach von Srimathi, U., Nagarajan, V., Chandiramouli, R.

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Arsenic pentafluoride surface adsorption studies on Kagome-phosphorene – a DFT outlook von Nagarajan, V., Chandiramouli, R.

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Silicene nanosheet device with nanopore to identify the nucleobases – A first-principles perspective von Chandiramouli, R., Nagarajan, V.

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Interaction properties of phenol and styrene from plastic fumes on β-Arsenene sheets: A first-principles study von Bhuvaneswari, R., Nagarajan, V., Chandiramouli, R.

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Novel ε-arsenene nanosheets for sensing toxic malathion and parathion – A first-principles approach von Bhuvaneswari, R., Nagarajan, V., Chandiramouli, R.

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Molecular adsorption studies of diethyl sulfide and ethyl methyl sulfide vapors on ζ-phosphorene nanoribbon – A first-principles insight von Bhuvaneswari, R., Nagarajan, V., Chandiramouli, R.

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Adsorption behavior of cytosine and guanine nucleobases on graphyne nanosheets: A DFT study von Madhumitha, S., Nagarajan, V., Chandiramouli, R.

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Adsorption Ability of Germanane Nanosheets Towards Nitrogen and Sulfur Mustard Gas Molecules: A First-Principles Study von Nagarajan, V., Chandiramouli, R.

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Sensing studies of DDT and Toxaphene molecules using chemi-resistive β-antimonene nanotubes based on first-principles insights von Bhuvaneswari, R., Nagarajan, V., Chandiramouli, R.

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Molecular adsorption of o-ethyltoluene and phenyl propane on square-octagon phosphorene nanosheet – A first-principles calculation von Nagarajan, V., Chandiramouli, R.

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Interaction studies of glycine, acetate and methylamine on β-tellurene nanoribbon – A first-principles analysis von Nagarajan, V., Chandiramouli, R.

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Adsorption of butyric acid and butyl acetate on arsenaluminane nanosheets based on first-principles study von Jyothi, M. S., Nagarajan, V., Chandiramouli, R.

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Reaction mechanisms for reduction of CO2 to CO on monolayer MoS2 von Xie, Yunlong, Li, Xiang, Wang, Yu, Li, Biwen, Yang, Lun, Zhao, Nian, Liu, Meifeng, Wang, Xiuzhang, Yu, Ying, Liu, J.-M.

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Tellurene based biosensor for detecting DNA/RNA nucleobases and amino acids: A theoretical insight von Guo, Haojie, Zheng, Kai, Cui, Heping, Yu, Jiabing, Tao, Lu-Qi, Li, Xiandong, Liao, Changrong, Xie, Lei, Chen, Xianping

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First-principles study of chalcogen-bonded self-assembly structures on silicene: Some insight into the fabrication of molecular architectures on surfaces through chalcogen bonding von Ren, Bohui, Lu, Yunxiang, Wang, Ranran, Liu, Honglai

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Unveiling thiol biomarkers: Glutathione and cysteamine von Gopika, M.G., Gopidas, Surya, Jayan, Gokul S., Arathy, P.S., Saraswathyamma, Beena

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