Rakesh Gupta

Employment

• Tata Consultancy Services Ltd Scientist
  2013 - Present

Education

• Indian Institute of Science ME
  2011 - 2013

Projects & Funding

Projects & funding information is unavailable.

Publications (49)

• Interaction of Choline-Based Ionic Liquids with Model Lipid Membranes: Force-Field Parametrization and Membrane Partitioning
  The Journal of Physical Chemistry B 2026 DOI: 10.1021/acs.jpcb.5c07830
  +Save
• Neural networks for the prediction of peel force for skin adhesive interface using FEM simulation
  Next Research 2026 DOI: 10.1016/j.nexres.2025.101145
  +Save
• CAGE ionic liquids meet biomembranes: unraveling molecular mechanisms and partitioning kinetics
  Soft Matter 2026 DOI: 10.1039/D6SM00351F
  +Save
• CAGE Ionic Liquids Meet Biomembranes: Unraveling Molecular Mechanisms and Partitioning Kinetics
  2026 DOI: 10.26434/chemrxiv.15002259/v1
  +Save
• Classification of tastants: A deep learning based approach
  Molecular Informatics 2023 DOI: 10.1002/minf.202300146
  +Save
• Modeling the effect of pH on the permeability of dried chitosan film
  Journal of Food Engineering 2023 DOI: 10.1016/j.jfoodeng.2023.111682
  +Save
• Multiscale modeling of molecule transport through skin’s deeper layers
  Computational Toxicology 2023 DOI: 10.1016/j.comtox.2023.100267
  +Save
• Corrigendum to “Investigating the nanostructure of a CER[NP]/CER[AP]-based stratum corneum lipid matrix model: A combined neutron diffraction & molecular dynamics simulations approach” [Biochim. Biophys. Acta – Biomembr., volume 1864, Issue 10, (2022) 18…
  Biochimica et Biophysica Acta - Biomembranes 2023 DOI: 10.1016/j.bbamem.2023.184159
  +Save
• Deep learning models for the estimation of free energy of permeation of small molecules across lipid membranes
  Digital Discovery 2023 DOI: 10.1039/D2DD00119E
  +Save
• Elucidating collective translocation of nanoparticles across the skin lipid matrix: a molecular dynamics study
  Nanoscale Advances 2023 DOI: 10.1039/D2NA00241H
  +Save