Madhulika Gupta

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Publications (20)

• Introduction to Energy Sources, Scenario, Pollution Problems, and Solutions
  2026 DOI: 10.1201/9781003736820-1
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• Hybrid polythiophene–metal composites as promising sensing materials for chemical warfare agents and chlorofluorocarbons
  RSC Advances 2026 DOI: 10.1039/D6RA00636A
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• Biogas Production from Lignocellulosic Biomass and Pretreatment Techniques
  2026 DOI: 10.1201/9781003736820-7
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• Computational Studies to Explore the Role of Ni‐Decorated Nanocages Comprising p‐block Elements for CO2 Sequestration
  ChemistrySelect 2025 DOI: 10.1002/slct.202502916
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• Structure-Based Design of Small-Molecule Inhibitors of Human Interleukin-6
  Molecules 2025 DOI: 10.3390/molecules30142919
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• Effect of Acetylation Patterns of Xylan on Interactions with Cellulose
  Biomacromolecules 2025 DOI: 10.1021/acs.biomac.4c01469
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• Exploring Heterogeneous Dynamical Environment around an Ensemble of Aβ42 Peptide Monomer Conformations
  Journal of Chemical Information and Modeling 2022 DOI: 10.1021/acs.jcim.2c00593
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• Solvation of gold nanoparticles passivated with functionalized alkylthiols: A molecular dynamics study
  Journal of Molecular Liquids 2022 DOI: 10.1016/j.molliq.2021.118342
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• Understanding catalyst inhibition from biogenic impurities in transfer hydrogenation of a biorenewable platform chemical
  Journal of Environmental Chemical Engineering 2022 DOI: 10.1016/j.jece.2022.107132
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• Spontaneous rearrangement of acetylated xylan on hydrophilic cellulose surfaces
  Cellulose 2021 DOI: 10.1007/s10570-021-03706-z
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