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We perform dynamical Monte Carlo simulation to study the forced translocation of compact polymer chains in three-dimensional lattices. The chains are driven through a nanopore connecting two infinite channels by an external field. The scaling properties of average translocation time τ and translocation time distribution (TTD) are studied. The effects of contact energy (ɛ C ), electric field...
Starting from a kinetically foldable criterion for designing fast-folding structures, we have investigated the foldabilities of all possible sequences coded in two letters through an exhaustive enumeration of model chains of a 16-mer protein that we performed using a simple off-lattice model. From a set of 32,896 sequences, we found only 145 sequences that were foldable. Through a comparison of the...
Monte Carlo method was applied to simulate self-condensing vinyl polymerization (SCVP) in the presence of multifunctional initiator with unequal reactive rate constants. Simulations showed that, with the increase of reactivity of multifunctional initiator, the molecular weight distribution decreases, the fraction of multi-armed hyperbranched polymers increases, and the best reactivity ratio of multifunctional...
The pulsed-laser polymerization in emulsions has been simulated by the Monte Carlo method. Our simulation shows that the best measure of the propagation rate coefficients K p is the peak maximum of molecular weight distribution for microemulsions when the droplets are small. However, the inflection point at the low-molecular-weight side of the peaks provides the best measure of K p ...
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