Molecular insights into the interaction of RONS and Thieno [3, 2-c] pyran analogs with SIRT6/COX-2: A molecular dynamics study DK Yadav, S Kumar, Saloni, S Misra, L Yadav, M Teli, P Sharma, ... Scientific reports 8 (1), 1-16, 2018 | 412 | 2018 |
Molecular docking, QSAR and ADMET studies of withanolide analogs against breast cancer DK Yadav, S Kumar, Saloni, H Singh, M Kim, P Sharma, S Misra, F Khan Drug Design, Development and Therapy 11, 1859, 2017 | 79 | 2017 |
Studies of the benzopyran class of selective COX-2 inhibitors using 3D-QSAR and molecular docking DK Yadav, Saloni, P Sharma, S Misra, H Singh, RL Mancera, K Kim, ... Archives of pharmacal research 41 (12), 1178-1189, 2018 | 34 | 2018 |
Novel SIRT1 inhibitor 15-deoxy-Δ12, 14-prostaglandin J2 and its derivatives exhibit anticancer activity through apoptotic or autophagic cell death pathways in SKOV3 cells IH Tae, EY Park, P Dey, JY Son, SY Lee, JH Jung, S Saloni, MH Kim, ... International journal of oncology 53 (6), 2518-2530, 2018 | 34 | 2018 |
Discovery of C-3 Tethered 2-oxo-benzo [1, 4] oxazines as potent antioxidants: bio-inspired based design, synthesis, biological evaluation, cytotoxic, and in silico molecular … V Sharma, PK Jaiswal, M Saran, DK Yadav, Saloni, M Mathur, AK Swami, ... Frontiers in chemistry 6, 56, 2018 | 14 | 2018 |
A computational study of potential therapeutics for COVID-19 invoking conceptual density functional theory Saloni, D Kumari, P Ranjan, T Chakraborty Structural Chemistry 33 (6), 2195-2204, 2022 | 11 | 2022 |
Electronic and Optical Properties of Lead‐free Double Perovskites A2BCl6 (A= Rb, Cs; B= Si, Ge, Sn) for Solar Cell Applications: A Systematic Computational Study Saloni, P Kumar, P Sharma, P Ranjan, T Chakraborty Journal of Physical Organic Chemistry, e4492, 2023 | 6 | 2023 |
Computation of atomic electronegativity values using atomic and covalent potential: a FSGO based study Saloni, D Kumari, H Tandon, M Labarca, T Chakraborty Journal of Mathematical Chemistry, 1-16, 2022 | 3 | 2022 |
An FSGO based Electronegativity Scale invoking the Electrophilicity Index D Kumari, Saloni, H Tandon, M Labarca, T Chakraborty ChemistrySelect 7 (44), e202202238, 2022 | 2 | 2022 |
A computational study of CuCrX2 (X= S, Se, Te) for intermediate band solar cell: Conceptual density functional theory approach S Saloni, P Ranjan, T Chakraborty Journal of Molecular Graphics and Modelling 124, 108534, 2023 | 1 | 2023 |
A computational study of ZnFeX2 (X= S, Se, Te) nano-clusters having photovoltaic applications S Saloni, P Ranjan, T Chakraborty Materials Science in Semiconductor Processing 164, 107608, 2023 | 1 | 2023 |
Application of floating spherical Gaussian orbital approach in redefining the atomic periodic descriptor D Kumari, S Saloni, M Labarca, T Chakraborty Journal of Mathematical Chemistry 61 (9), 1924-1935, 2023 | | 2023 |