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Presence Current · Arkansas
Last published 2026
Sources OpenAlex · ORCID
Refreshed 2026-10-06

Jeevapani J. Hettige

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Also affiliated: Stowers Institute for Medical Research (2024–2026); University of Iowa (2012–2016); Los Alamos National Laboratory (2019–2022); Pacific Northwest National Laboratory (2021–2024); University of Arkansas System (2018); Indian Institute of Technology Delhi (2016)

17 h-index 45 pubs 1,609 cited

  • Molecular Dynamics Simulation
  • Peptoids
  • Ionic Liquids
  • Humans
  • Lipids
  • Water
  • Cations
  • Models, Molecular
  • Machine Learning
  • Signal Transduction
  • Protein Multimerization
  • Anti-Bacterial Agents
  • Biocompatible Materials
  • Microbial Sensitivity Tests
  • Membrane Proteins

Biography and Research Information

OverviewAI-generated summary

Jeevapani J. Hettige's research focuses on computational studies of molecular systems, particularly the behavior of ionic liquids and their interactions with biological molecules. His work has investigated the relationship between the structure of ionic liquids, including variations in cation alkyl groups and anion properties, and their dynamic characteristics. Hettige has also explored phenomena such as bicontinuity and ordering in different types of ionic liquids. More recently, his research has extended to applying machine learning techniques to model complex biological processes, such as the lipid-dependent dynamics of RAS signaling proteins. His publications also cover fundamental aspects of ionic liquid structure, including SAXS analysis to understand ordering and the role of anions as structural reporters. Hettige's scholarly contributions are reflected in an h-index of 17, with 44 total publications and over 1,600 citations.

Metrics

  • h-index: 17
  • Publications: 45
  • Citations: 1,609

Selected Publications

  • Charge reversal in the heparin-binding pocket enhances the stability and activity of the human FGF1 (2026)
    Biophysical Journal DOI OpenAlex
  • Lipid-dependent conformational dynamics of bacterial ATP-binding cassette transporter Sav1866 (2024)
    bioRxiv (Cold Spring Harbor Laboratory) DOI OpenAlex
  • An investigation of the YidC-mediated membrane insertion of Pf3 coat protein using molecular dynamics simulations (2022)
    Frontiers in Molecular Biosciences 7 citations DOI OpenAlex
  • An Investigation of the YidC-Mediated Membrane Insertion of Pf3 Coat Protein Using Molecular Dynamics Simulations (2022)
    bioRxiv (Cold Spring Harbor Laboratory) 3 citations DOI OpenAlex
  • An investigation of the YidC-mediated membrane insertion of Pf3 coat protein using molecular dynamics simulations (2022)
    Biophysical Journal DOI OpenAlex
  • An Investigation of the YidC-Mediated Membrane Insertion of a Pf3 Coat Protein Using MD Simulations (2020)
    Biophysical Journal 1 citation DOI OpenAlex
  • The Role of a Crystallographically Unresolved Cytoplasmic Loop in Stabilizing the Bacterial Membrane Insertase YidC2 (2019)
    Scientific Reports 16 citations DOI OpenAlex
  • The Role of a Crystallographically Unresolved Cytoplasmic Loop in Stabilizing the Bacterial Membrane Insertase YidC2 (2019)
    bioRxiv (Cold Spring Harbor Laboratory) 1 citation DOI OpenAlex
  • Lipid-Dependent Alternating Access Mechanism of a Bacterial Multidrug ABC Exporter (2019)
    ACS Central Science 44 citations DOI OpenAlex
  • Lipid-Dependent Alternating Access Mechanism in ABC Exporters Revealed using Microsecond-Level Molecular Dynamics Simulations (2018)
    Biophysical Journal DOI OpenAlex
  • Lipid-Dependent Alternating Access Mechanism of a Bacterial Multidrug ABC Transporter: A Molecular Dynamics Study (2018)
    Biophysical Journal DOI OpenAlex
  • Microsecond-Level Simulations Reveal Membrane Protein Insertion Mechanism of Insertase YidC (2018)
    Biophysical Journal DOI OpenAlex
  • All-Atom Molecular Dynamics Simulation of Stealth Liposomes (2017)
    Biophysical Journal 1 citation DOI OpenAlex
  • Couplings between Local and Global Conformational Changes in Proton-Coupled Oligopeptide Transporters (2017)
    Biophysical Journal DOI OpenAlex
  • What Can and Cannot Be Learned from Molecular Dynamics Simulations of Bacterial Proton-Coupled Oligopeptide Transporter GkPOT? (2016)
    The Journal of Physical Chemistry B 32 citations DOI OpenAlex

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Collaboration Network

16 Collaborators 3 Institutions 1 Country

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