Anjali Murmu

About

Anjali Murmu is a PhD candidate in the Department of Pharmacy at Guru
Ghasidas University, Bilaspur. Her research interests include cancer and
Quantitative Structure-Activity Relationship (QSAR) studies. With over four
years of research experience, she specializes in in-silico toxicity assessment
of hazardous chemicals and the design of novel small molecules targeting
various diseases. Anjali has authored numerous research and review articles in peer-reviewed
journals, contributing significantly to the field of QSAR.

Employment

Employment history is unavailable.

Education

Education history is unavailable.

Projects & Funding

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Publications (13)

• Discovery of newer 1,3,4-Oxadiazole clubbed Isoindoline-1,3-dione derivatives as potential anticancer agents: Design, machine learning, synthesis, molecular docking, ADMET, DFT and MD simulation
  Computational Biology and Chemistry 2025 DOI: 10.1016/j.compbiolchem.2025.108492
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• Discovery of novel 1,3,4-oxadiazole derivatives as anticancer agents targeting thymidine phosphorylase: pharmacophore modelling, virtual screening, molecular docking, ADMET and DFT analysis
  SAR and QSAR in Environmental Research 2025 DOI: 10.1080/1062936X.2025.2512385
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• Exploring QSTR and q-RASTR modeling of agrochemical toxicity on cabbage for environmental safety and human health
  Environmental Science and Pollution Research 2025 DOI: 10.1007/s11356-025-36033-y
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• Multilayered screening for multi-targeted anti-Alzheimer’s and anti-Parkinson’s agents through structure-based pharmacophore modelling, MCDM, docking, molecular dynamics and DFT: a case study of HDAC4 inhibitors
  In Silico Pharmacology 2025 DOI: 10.1007/s40203-024-00302-4
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• Combinatorial Design of Imidazole/Triazole Linked Aryl-Substituted Derivatives as CYP17 Inhibitors Exploring Hansch and Molecular Docking Approach
  Medinformatics 2025 DOI: 10.47852/bonviewmedin42024158
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• Unveiling the interspecies correlation and sensitivity factor analysis of rat and mouse acute oral toxicity of antimicrobial agents: first QSTR and QTTR Modeling report
  Toxicology Research 2024 DOI: 10.1093/toxres/tfae191
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• 1,3,4-Oxadiazole: An Emerging Scaffold to Inhibit the Thymidine Phosphorylase as an Anticancer Agent
  Current Medicinal Chemistry 2024 DOI: 10.2174/0929867331666230712113943
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• Thiazolidinedione an auspicious scaffold as PPAR-γ agonist: its possible mechanism to Manoeuvre against insulin resistant diabetes mellitus
  European Journal of Medicinal Chemistry Reports 2024 DOI: 10.1016/j.ejmcr.2024.100160
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• Integrated predictive QSAR, Read Across, and q-RASAR analysis for diverse agrochemical phytotoxicity in oat and corn: A consensus-based approach for risk assessment and prioritization
  Environmental Science and Pollution Research 2024 DOI: 10.1007/s11356-024-31872-7
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• In silico soil degradation and ecotoxicity analysis of veterinary pharmaceuticals on terrestrial species: first report
  Toxicology Research 2024 DOI: 10.1093/toxres/tfae020
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