research

Our research focuses on development of computational models of soft matter to describe systems involving biomaterials in collaborative projects with experimentalists.

current projects

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Peptide nanofibrils (PNF) in retroviral gene transfer

Self-assembly mechanisms of PNFs
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Aggregation of supramolecular polymers

Identification of structural transitions in supramolecular systems with machine learning models
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Role of PNFs in retroviral gene transfer

Simulations of how PNFs aid retroviral gene transfer

past projects

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Degradation in acrylic paints

multi-scale materials modeling to predict degradation of art-related materials
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Peptide Amphiphiles (PA)

design of stimuli-responsive biomaterials based on PAs
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Stimuli-responsive materials

multifunctional materials with properties that are turned on/off with external stimuli
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Amyloid Beta Aggregation

inhibition of β-amyloid aggregation by Cobalt(III) Schiff base complexes
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Vibrational probe of aqueous electrolytes

vibrational solvatochromism and dynamics of dilute acetone as a carbonyl probe in simple aqueous electrolytes