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N. Karthik

Also known as: Karthik Nallasamy

Kalasalingam Academy of Research and Education (Deemed to be University), Sri Kaliswari College (Affiliated to) Madurai Kamaraj University

ORCID iD 0009-0008-9422-4350
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About

Currently pursuing doctoral research in Physics, with specialization in Computational and Theoretical Condensed Matter Physics. The research focuses on the quantum chemical investigation of organic and bioactive molecular systems using Density Functional Theory (DFT). Emphasis is placed on the systematic evaluation of structural, electronic, vibrational, and optical properties, along with the comparison of theoretical results and experimental data to ensure reliability and scientific validity.
Research expertise includes molecular modeling, geometry optimization, frontier molecular orbital (HOMO-LUMO) analysis, molecular electrostatic potential (MEP) mapping, natural bond orbital (NBO) analysis, and spectroscopic interpretation (FT-IR, FT-Raman, and UV-Vis). Additional research interests involve molecular docking, virtual screening, protein–ligand interaction analysis, and ADMET prediction for rational drug design and pharmaceutical applications.

Employment

Employment history is unavailable.

Education

  • Kalasalingam Academy of Research and Education (Deemed to be University) Doctor of Philosophy
    2023 - Present
  • Kalasalingam Academy of Research and Education (Deemed to be University) Master of Science
    2021 - 2023
  • Sri Kaliswari College (Affiliated to) Madurai Kamaraj University Bachelor of Science
    2018 - 2021

Projects & Funding

Projects & funding information is unavailable.

Publications (388)