Kaliraj Chandran

Docking simulation and ADMET prediction based investigation on the phytochemical constituents of Noni (Morinda citrifolia) fruit as a potential anticancer drug

Kaliraj Chandran, Drose Ignatious Shane Michaelson, Azar Zochedh et al. · In Silico Pharmacology · 2022 · 65 citations · Full text

Medicinal Chemistry, Polyphenolics, Biochemistry +11

Molecular simulation of naringin combined with experimental elucidation – Pharmaceutical activity and Molecular docking against Breast cancer

Azar Zochedh, Kaliraj Chandran, Mohana Priya et al. · Journal of Molecular Structure · 2023 · 55 citations

Molecular Pharmacology, Engineering, Biochemistry +10

Observations into quantum simulation, spectroscopy, electronic properties, pharmacokinetics and molecular docking analysis of lawsone against breast cancer

Kaliraj Chandran, Azar Zochedh, S. Asath Bahadur et al. · Journal of Molecular Structure · 2023 · 41 citations

Medicinal Chemistry, Engineering, Biochemistry +10

Exploring the co‐activity of <scp>FDA</scp> approved drug gemcitabine and docetaxel for enhanced anti‐breast cancer activity: <scp>DFT</scp>, docking, molecular dynamics simulation and pharmacophore studies

Sureba Sukumaran, Azar Zochedh, Kaliraj Chandran et al. · International Journal of Quantum Chemistry · 2024 · 41 citations

Molecular Dynamics Simulation, Peptide Science, Pharmacotherapy +25

DFT Simulation of Berberine Chloride with Spectroscopic Characterization – Biological activity and Molecular Docking against Breast Cancer

Azar Zochedh, Kaliraj Chandran, Mohana Priya et al. · Polycyclic aromatic compounds · 2023 · 32 citations