Computational Hybrid Soft Materials Laboratory

Software for Research Community

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• Molecular Dynamics- Lattice Boltzmann: a hybrid particle dynamics and discreet fluid technique which captures the dynamic coupling between the fluid lattice and the particle dynamics.
  • Link

• RepEx: a replica exchange framework designed for extensibility to new kinds of exchange methods and performance at scale.
  • GITHUB link

• Analysis Codes.
  • Analysis Codes for Amphiphilic Macromolecules in DSPC membranes

Movies

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• Synthetic octopus or hairy vesicles.(paper1 & paper2)
  • Formation of synthetic octopus
  • Surface reconfigurable synthetic octopus
  • Synthetic octopus playing beach ball

• Triblock copolymer for drug delivery (in collaboration with New Jersey Center for Biomaterials).(paper )
  • Formation of tyrosine-based triblock polymer micelle.

• Electrostaticaly-induced adsorption of charged patchy nanoparticle.(paper)
  • Charged Patchy Nanoparticle Adsorption

• Synthetic Octopi under confinement.(paper)
  • Formation of synthetic octopus under confinement

• Interactions between Multicomponent Vesicles and Antimicrobial Peptide-Inspired Nanoparticles.(paper)
  • Spontaneous transverse diffusion of peptide-inspired nanoparticles
  • Aggregation of peptide-inspired nanoparticles and their spontaneous insertion into vesicle