In silico prediction of potential inhibitors for the main protease of SARS-CoV-2 using molecular docking and dynamics simulation based drug-repurposing Y Kumar, H Singh, CN Patel Journal of infection and public health 13 (9), 1210-1223, 2020 | 225 | 2020 |
Pharmacophore-based virtual screening of catechol-o-methyltransferase (COMT) inhibitors to combat Alzheimer’s disease CN Patel, JJ Georrge, KM Modi, MB Narechania, DP Patel, FJ Gonzalez, ... Journal of Biomolecular Structure and Dynamics 36 (15), 3938-3957, 2018 | 66 | 2018 |
Pinpointing the potential hits for hindering interaction of SARS-CoV-2 S-protein with ACE2 from the pool of antiviral phytochemicals utilizing molecular docking and molecular … CN Patel, D Goswami, DG Jaiswal, RM Parmar, HA Solanki, HA Pandya Journal of Molecular Graphics and Modelling 105, 107874, 2021 | 42 | 2021 |
In vitro and in silico analysis of Thymus serpyllum essential oil as bioactivity enhancer of antibacterial and antifungal agents D Salaria, R Rolta, CN Patel, K Dev, A Sourirajan, V Kumar Journal of Biomolecular Structure and Dynamics 40 (20), 10383-10402, 2022 | 35 | 2022 |
Identification of antiviral phytochemicals as a potential SARS-CoV-2 main protease (Mpro) inhibitor using docking and molecular dynamics simulations CN Patel, SP Jani, DG Jaiswal, SP Kumar, N Mangukia, RM Parmar, ... Scientific Reports 11 (1), 20295, 2021 | 35 | 2021 |
Identification of potential inhibitors of coronavirus hemagglutinin-esterase using molecular docking, molecular dynamics simulation and binding free energy calculation CN Patel, SP Kumar, HA Pandya, RM Rawal Molecular Diversity 25, 421-433, 2021 | 35 | 2021 |
Molecular docking studies of phytocompounds of Rheum emodi Wall with proteins responsible for antibiotic resistance in bacterial and fungal pathogens: in silico approach to … R Rolta, D Salaria, V Kumar, CN Patel, A Sourirajan, DJ Baumler, K Dev Journal of Biomolecular Structure and Dynamics 40 (8), 3789-3803, 2022 | 32 | 2022 |
Berries anthocyanins as potential SARS-CoV–2 inhibitors targeting the viral attachment and replication; molecular docking simulation O Messaoudi, H Gouzi, AN El-Hoshoudy, F Benaceur, C Patel, ... Egyptian Journal of Petroleum 30 (1), 33-43, 2021 | 32 | 2021 |
A resorcinarene-based “turn-off” fluorescence sensor for 4-nitrotoluene: Insights from fluorescence and 1H NMR titration with computational approach U Panchal, K Modi, S Dey, U Prajapati, C Patel, VK Jain Journal of Luminescence 184, 74-82, 2017 | 32 | 2017 |
The effect of bisphenol A on testicular steroidogenesis and its amelioration by quercetin: an in vivo and in silico approach S Samova, CN Patel, H Doctor, HA Pandya, RJ Verma Toxicology research 7 (1), 22-31, 2018 | 29 | 2018 |
Ameliorative effects of quercetin against bisphenol A-caused oxidative stress in human erythrocytes: an in vitro and in silico study NP Sangai, CN Patel, HA Pandya Toxicology research 7 (6), 1091-1099, 2018 | 28 | 2018 |
Highly selective and sensitive fluorescent sensor: Thiacalix [4] arene-1-naphthalene carboxylate for Zn2+ ions SM Darjee, KM Modi, U Panchal, C Patel, VK Jain Journal of Molecular Structure 1133, 1-8, 2017 | 26 | 2017 |
Identification of novel inhibitors of SARS‐CoV‐2 main protease (Mpro) from Withania sp. by molecular docking and molecular dynamics simulation S Verma, CN Patel, M Chandra Journal of computational chemistry 42 (26), 1861-1872, 2021 | 25 | 2021 |
A new N-methylhydrazinecarbothioamide incorporated “naked-eye” and “turn-off” chemosensor for selective and low detection of Cu2+ ions and computation study B Mohan, K Modi, C Patel, S Kumar, T Zhiyu, H You, P Ren Journal of Photochemistry and Photobiology A: Chemistry 408, 113097, 2021 | 24 | 2021 |
Synthesis, biological evaluation and computational study of novel isoniazid containing 4H-Pyrimido [2, 1-b] benzothiazoles derivatives MN Bhoi, MA Borad, DJ Jethava, PT Acharya, EA Pithawala, CN Patel, ... European journal of medicinal chemistry 177, 12-31, 2019 | 24 | 2019 |
Thiacalix [4] arene-tetra-(quinoline-8-sulfonate): a Sensitive and Selective Fluorescent Sensor for Co (II) K Modi, U Panchal, S Dey, C Patel, A Kongor, HA Pandya, VK Jain Journal of fluorescence 26, 1729-1736, 2016 | 23 | 2016 |
In-Silico analysis reveals lower transcription efficiency of C241T variant of SARS-CoV-2 with host replication factors MADP1 and hnRNP-1 A Chaudhari, M Chaudhari, S Mahera, Z Saiyed, NM Nathani, S Shukla, ... Informatics in Medicine Unlocked 25, 100670, 2021 | 22 | 2021 |
Structural motifs of oxacalix [4] arene for molecular recognition of nitroaromatic explosives: Experimental and computational investigations of host-guest complexes M Panchal, A Kongor, M Athar, K Modi, C Patel, S Dey, M Vora, ... Journal of Molecular Liquids 306, 112809, 2020 | 22 | 2020 |
A multiparametric organ toxicity predictor for drug discovery CN Patel, SP Kumar, RM Rawal, DP Patel, FJ Gonzalez, HA Pandya Toxicology Mechanisms and Methods, 2019 | 21 | 2019 |
Cardiotonic steroids as potential Na+/K+-ATPase inhibitors – a computational study CN Patel, SP Kumar, KM Modi, MN Soni, NR Modi, HA Pandya Journal of Receptors and Signal Transduction, 2019 | 21 | 2019 |