A MARTINI-Compatible Coarse-Grained Model for the Mesoscale Simulation of Peptoids

Mingfei Zhao,Janani Sampath,Sarah Alamdari,Gillian Shen,Chun-Long Chen,Christopher J. Mundy,Jim Pfaendtner,Andrew L. Ferguson

A MARTINI-Compatible Coarse-Grained Model for the Mesoscale Simulation of Peptoids

2020

Mingfei Zhao
Janani Sampath
Sarah Alamdari
Gillian Shen
Chun-Long Chen
Christopher J. Mundy
Jim Pfaendtner
Andrew L. Ferguson

Peptoids (poly-N-substituted glycines) are a class of synthetic polymers that are regioisomers of peptides (poly-C-substituted glycines) in which the point of side-chain connectivity is shifted fro...

Keywords:

mesoscale simulation
Computational science
Geology

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