Coarse-Grained Modeling
and Simulations of Thermoresponsive
Biopolymers and Polymer
Nanocomposites with Specific
and Directional Interactions
Arthi Jayaraman, Arjita Kulshreshtha, Phillip Taylor,
and Ammu Prhashanna
Abbreviations
ONA Oligonucleic acid
DNA Deoxyribonucleic acid
RNA Ribonucleic acid
CLP Collagen-like peptide
CG
Coarse-grained
IN
Counterion
BB
Backbone
HB
Hydrogen bond
PNC Polymer nanocomposite
PGP Polymer grafted particle
Submitted to
FOMMS 2018 Special Issue: Molecular Modeling and Simulation: Applications and
Perspectives.
A. Jayaraman (B) · A. Kulshreshtha · P. Taylor · A. Prhashanna
Department of Chemical and Biomolecular Engineering, Colburn Laboratory, University of
Delaware, 150 Academy Street, Newark, DE 19716, USA
e-mail: arthij@udel.edu
A. Jayaraman
Department of Materials Science and Engineering, Dupont Laboratory, University of Delaware,
Newark, DE 19716, USA
© The Author(s), under exclusive license to Springer Nature Singapore Pte Ltd. 2021
E. J. Maginn and J. Errington (eds.), Foundations of Molecular Modeling
and Simulation, Molecular Modeling and Simulation,
https://doi.org/10.1007/978-981-33-6639-8_3
37