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Group


Principal investigator
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Prabal K. Maiti

Principal investigator

One of my major research goal is to pursue theoretical and numerical modeling connecting molecular and macroscopic length scales to improve basic understanding of soft-matter and biological systems, both from a fundamental and an applied point of view. These aims imply development of appropriate molecular models and efficient computational techniques, incorporating accurate force fields for intra- and intermolecular interactions.

  • maiti@iisc.ac.in
  • prabalmaiti@gmail.com

Current Ph.D.
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Jeet Majumdar

Int. Ph.D.

Jack of some trades and master in Physics. This website was developed by me and therefore all suggestions regarding this site are welcome in my inbox. Apart from such hobbies, I mostly spend time on investigating the behaviour of nano-confined liquids.

  • jeetmajumdar@iisc.ac.in
  • mail2majumdar@gmail.com
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Nayana

Int. Ph.D.

I am interested in studying the scalar models of active matter and study phase separation in such systems using Molecular Dynamics simulation.

  • nayanav@iisc.ac.in
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Soham Mandal

Int. Ph.D.

Thermal Transport in Materials, Condensed Matter Physics, Computational Physics

  • sohammandal@iisc.ac.in
  • sohammandal97@gmail.com
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Sandip Mandal

Ph.D.

Biophysics, Statistical Mechanics, Soft Matter, Molecular Dynamics

  • sandipmandal@iisc.ac.in
  • sandipmandal.ph@gmail.com
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Jaydeep Mandal

Ph.D.

Soft matter physics

  • jaydeepm@iisc.ac.in
  • jaydeepmandal.211@gmail.com
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Amal R S

Ph.D.

I am working on Artificial Intelligence/ Machine Learning applications in the field of Molecular Dynamics. I am also interested in Quantum Molecular Dynamics and Quantum Computing.

  • amalrs@iisc.ac.in
  • amlrsd7.phys@gmail.com
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Parvathi K

Ph.D.

Studies liquid crystalline phases of soft chiral rods.

  • parvathik@iisc.ac.in
  • parvathi532001@gmail.com
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Abhigyan Hazarika

Ph.D.

Molecular Simulations, Soft Condensed Matter, Condensed Matter Physics.

  • abhigyanh@iisc.ac.in
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Afi J M

Ph.D.

Molecular Simulations, Soft Condensed Matter, Condensed Matter Physics.

  • afijm@iisc.ac.in
  • afijm15@gmail.com
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Shubham Basera

Ph.D.

Molecular Simulations, Soft Condensed Matter, Condensed Matter Physics.

  • bshubham@iisc.ac.in

Current Postdoc. and R.A.
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Sunita Muduli

Post Doc.

Research Interest: Exploring the dynamic behavior of biomolecules through molecular dynamics (MD) simulations, with a focus on the structural and mechanistic properties of proteins and protein-ligand complexes at atomic resolution. Motivated by the development and implementation of advanced simulation techniques to enhance sampling efficiency and predict molecular interactions, contributing to biophysics.

  • sunitamuduli675@gmail.com
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Sipra Mohapatra

Post Doc.

Molecular Simulations, Soft Condensed Matter, Condensed Matter Physics.

  • sipramohapatr01@gmail.com
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Yogendra Patel

Post Doc.

The primary emphasis of my research lies in the investigation of biological membranes, biopolymers, nanomaterials, drug-protein interaction, and polyelectrolytes. The present study involves the investigation of various structural and thermodynamic features via the use of molecular dynamics (MD) simulations, along with the implementation of advanced simulation methodologies to improve accuracy and efficiency.

  • yogendrapatel.che@gmail.com
  • kyogendra@iisc.ac.in

Masters & U.G.
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Arun kumar S

BS(Research)

  • arunks@iisc.ac.in
  • krishna617587@gmail.com
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Dharanish Rajendra

MS (Research)

I study the properties of biological systems like the surface proteins of HIV and also the liquid crystalline properties of rod like particles under various constraints.

  • dharanishr@iisc.ac.in
  • dharanish1132000@gmail.com