Career

Experience & Education

Five-plus years of doctoral research in inorganic synthesis and computational chemistry, underpinned by formal training in CADD at India's premier drug-discovery institute.

Positions

Work Experience

Doctoral Researcher — Inorganic & Medicinal Chemistry

University of Lucknow, India

Dec 2020 – Jan 2026
  • Built a structurally diverse library of ten Ru(III) and half-sandwich Ru–arene Schiff-base complexes as anticancer and antimycobacterial candidates.
  • Executed multistep organometallic synthesis; confirmed structures by ¹H/¹³C NMR, FT-IR, UV-Vis, X-ray diffraction, and CHNS analysis.
  • Applied DFT, HOMO–LUMO, and MEP analysis alongside AutoDock molecular docking to establish predictive structure–activity relationships.
  • Coordinated anticancer, antimycobacterial, and antioxidant evaluation with partner laboratories.
  • Mentored junior researchers in synthesis, spectroscopic characterisation, and computational workflows.

Trainee — Computational Approaches to Drug Design (CADD)

CSIR – Central Drug Research Institute (CDRI), Lucknow

Jan – Mar 2019
  • Completed an intensive 8-week certificate programme in molecular modelling, virtual screening, and molecular docking.
  • Gained hands-on exposure to bioinformatics tools applied to pharmaceutical drug discovery.
Academics

Education

2020 – 2026

Ph.D., Chemistry

University of Lucknow

NAAC A++ · Thesis: Synthesis, Characterization and Biological Evaluation of Ruthenium Complexes with Different Amines · Supervisor: Dr. Ashok Kumar Singh

2016 – 2018

M.Sc., Chemistry

Isabella Thoburn Degree College, Lucknow

2013 – 2016

B.Sc., Zoology, Botany & Chemistry

University of Lucknow

2019

Certificate — CADD

CSIR – Central Drug Research Institute

8-week intensive programme in molecular modelling, virtual screening, and molecular docking.

Expertise

Skills & Tools

DFTGAUSSIANAutoDockDiscovery StudioRDKitChemDrawPythonADMEQSARSARMolecular DockingMolecular Modelling¹H NMR¹³C NMRFT-IRUV-VisX-Ray CrystallographyCHNS AnalysisOrganometallic SynthesisSchiff-Base LigandsScientific WritingPeer-Reviewed PublishingJunior Mentoring
Dissemination

Conferences & Presentations

Poster · International2025

Synthesis, Characterization, Molecular Docking and Biological Evaluation of Ruthenium Complexes

30th ISCB International Conference (ISCB-2025) · International Society for Chemical and Biological Sciences

Oral · National Seminar2024

Synthesis, Spectral Studies and Molecular Docking of Thiosemicarbazide Ligands and Ruthenium Complexes

National Seminar on Advancement and Strategies for Sustainable Development & Environmental Protection · Lucknow

Paper · National Conference2023

Synthesis, Characterization, Molecular Docking and Biological Evaluation of Ruthenium Complexes

Aryabhat Institute of Academics and Research & Goel Institute of Higher Studies (Affiliated to University of Lucknow)

Workshop2022

HPTLC: Technique and Applications

Anchrom Enterprises (I) Pvt. Ltd. & Smriti College of Pharmaceutical Education

Looking Ahead

Postdoctoral Interests

Seeking a postdoctoral position in computational and medicinal inorganic chemistry, with the goal of integrating predictive modelling, computational chemistry, and experimental validation to accelerate the discovery of metal-based therapeutics.

Research Interests

  • Computational drug discovery for metal-based therapeutics
  • DFT-guided molecular design and experimental validation
  • Structure–activity relationship (SAR) and lead optimisation
  • Metallodrug–biomolecule interactions (proteins, DNA, and other biological targets)
  • In vivo behaviour, pharmacokinetics, and biodistribution of metal-based therapeutics
  • Machine learning and cheminformatics for medicinal inorganic chemistry
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