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RESEARCH PAPER · Journal of Molecular Structure · 2021

Structural, spectroscopic, and in silico studies of 3-(dimethylamino)-1-(thiophen-2-yl)propan-1-ol: A potential antidepressant agent

Poojith Nuthalapati, Madhuprasad Kigga, J. John Rose, Krishna Murthy Potla, Suneetha Vankayalapati, Sampath Chinnam, Suchetan Parameshwar Adimoole, Renjith Raveendran Pillai

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Structural, spectroscopic, and in silico studies of 3-(dimethylamino)-1-(thiophen-2-yl)propan-1-ol: A potential antidepressant agentOriginalBinding studies of sertraline hydrochloride with CT-DNA using experimental and computational techniques20A comparative study of structural and spectroscopic properties of three structurally similar mechanically bending organic single crystals – 2-Amino-3-nitro-5-halo (halo = Cl, Br, or I) pyridine6Design and synthesis of isoniazid-based pyrazolines as potential inhibitors of Mycobacterium tuberculosis with promising radical scavenging action: In-vitro and in-silico evaluations23Homoleptic metal complexes derived from hydrazones as ligand; synthesis, cytotoxic activity, photoluminescence properties and ADMET studies20First-principles study of the physical properties and Hirshfeld surface analysis of the antidepressants duloxetine and sertraline0Multifaceted study of a pyrimidine sulfonamide derivative: structure, reactivity, optoelectronics, and bioactivity0

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  1. Binding studies of sertraline hydrochloride with CT-DNA using experimental and computational techniques

    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2023-05-24

    Palak Sharma, Priyanka Gopi, Shweta Singh, Majji Sai Sudha Rani, Prateek Pandya

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  2. A comparative study of structural and spectroscopic properties of three structurally similar mechanically bending organic single crystals – 2-Amino-3-nitro-5-halo (halo = Cl, Br, or I) pyridine

    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2023-06-30

    Krishna Murthy Potla, Suchetan Parameshwar Adimule, Poojith Nuthalapati, Francisco A. P. Osório, Clodoaldo Valverde, Yohannan Sheena Mary, Suneetha Vankayalapati

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  3. Design and synthesis of isoniazid-based pyrazolines as potential inhibitors of Mycobacterium tuberculosis with promising radical scavenging action: In-vitro and in-silico evaluations

    Journal of Molecular Structure · 2023-09-15

    Jyoti Rasgania, Renu Gavadia, Mandira Varma Basil, Varsha Chauhan, Sanjay Kumar, Satbir Mor, Devender Singh, Komal Jakhar

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  4. Homoleptic metal complexes derived from hydrazones as ligand; synthesis, cytotoxic activity, photoluminescence properties and ADMET studies

    Journal of Molecular Structure · 2024-01-06

    Ahmet Oral Sarıoğlu, Zafer Bulut, Demet Taşdemir Kahraman, Semih Güler, Özge Güngör, Ayşegül Karaküçük‐İyidoğan, Emine Elçin Oruç‐Emre

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  5. First-principles study of the physical properties and Hirshfeld surface analysis of the antidepressants duloxetine and sertraline

    Physical review. B./Physical review. B · 2024-12-18

    Rudiere Luz Araújo, José Xavier Neto, Umberto Laino Fulco, Jonas Ivan Nobre Oliveira, E.L. Albuquerque, L. R. da Silva, Alberto Torres, M. L. Lyra, Vinícius Manzoni

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  6. Multifaceted study of a pyrimidine sulfonamide derivative: structure, reactivity, optoelectronics, and bioactivity

    Phosphorus, sulfur, and silicon and the related elements · 2026-03-02

    Krishna Murthy Potla, Suneetha Vankayalapati, J. N. Cheerlin Mishma, S. Janani, Sanja J. Armaković, Stevan Armaković

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