BANERJEE, PALLAVI; Roy, Sudip; Nair, Nitish
(American Chemical Society, 2018-02)
We present a mesoscale model of aqueous polyacrylamide in the infinitely dilute concentration regime, by combining an extant coarse-grained (CG) force-field, MARTINI, and the Iterative Boltzmann Inversion protocol (IBI). ...