Tarak Karmakar, Chemistry, IIT Delhi

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Doing a BTP, MTP, PhD, internship or RA position under Karmakar, scored on five separate axes.

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Mentorship5

1 · left yourself to itclosely guided · 10

Availability5

1 · weeks to get a replyresponds same day · 10

Freedom5

1 · told exactly what to dopicked my own direction · 10

Workload5

1 · lightpunishing · 10

Credit5

1 · contribution went unacknowledgedscrupulously fair on authorship · 10

These are deliberately not all “high is good”. Someone who wants heavy guidance and someone who wants total autonomy are looking for opposite ends of the Freedom axis. Answer honestly about what it was like; readers will judge fit.

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Areas listed by the department

Molecular Dynamics SimulationsMethod DevelopmentEnhanced Sampling& Machine Learning (ML in Chemistry/Materials/Biology)

Publications, via OpenAlex

17h-index

864Citations

164Works

31i10

Topic clusters

Crystallography and molecular interactionsCrystal structures of chemical compoundsCrystal Structures and Propertiesnanoparticles nucleation surface interactionsNanocluster Synthesis and Applications

Most recent

Predicting Aqueous Solubility of Pharmaceutical Cocrystals Using Constant Chemical Potential Enhanced Sampling Simulations · The Journal of Physical Chemistry Letters, 2026
Concerted, Facile CO2 Hydrogenation in Ni-MOF-74 Revealed by Machine Learning Interatomic Potential-Based Enhanced Sampling Simulations · ChemRxiv, 2026
Local Variational Graph Coarsening for Machine Learning Coarse-Grained Molecular Dynamics Simulations · Journal of Chemical Theory and Computation, 2026
Collective Reaction Dynamics during Ligand Exchange in Atomically Precise Metal Nanoclusters · ChemRxiv, 2026
Conformational Dynamics and Inter-cluster Metal Exchange in DNA-Templated Silver Nanocluster · ChemRxiv, 2026

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