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Deshmukh Group
Computational Design of Hybrid Materials (CDHM)
Current Research Activities:
Development of force-field parameters as well as the design of novel materials using hybrid approaches that integrate molecular dynamics simulations, optimization algorithms, and machine learning.
Application of coarse-grained models to study self-assembly mechanism and polymer architectures at molecular level.
Large-Scale atomistic simulations -- Structure-property relationships in stimuli-sensitive polymers.
Reactive molecular dynamics -- Polymer degradation and Tribology.
Tribology of carbohydrate-based lubricants
Our Sponsors:
We Thank Following Sponsors for their Generous Support to Our Research --
Jeffress Trust --
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