Dissipative Particle Dynamics Approaches to Modeling …
99
126. Prhashanna A, Khan SA, Chen SB (2016) Kinetics of chain exchange between diblock
copolymer micelles. Macromol Theory Simul 25(4):383–391
127. Vishnyakov A, Lee MT, Neimark AV (2013) Prediction of the critical micelle concentration of
nonionic surfactants by dissipative particle dynamics simulations. J Phys Chem Lett 4(5):797–
802
128. Chansuna M, Pimpha N, Vao-soongnern V (2014) Mesoscale simulation and experimental
studies of self-assembly behavior of a PLA-PEG-PLA triblock copolymer micelle for
sustained drug delivery. J Polym Res 21(6)
129. He PT et al (2010) Complex micelles from the self-assembly of amphiphilic triblock
copolymers in selective solvents. J Chem Phys 132(20)
130. Huang JH, Fan ZX, Ma ZX (2013) Dissipative particle dynamics simulations on self-assembly
of rod-coil-rod triblock copolymers in a rod-selective solvent. J Chem Phys 139(6)
131. Zhou Y et al (2014) Dissipative particle dynamics simulation on self-assembly behavior of
rod-coil-rod triblock copolymer in solutions. Macromol Theory Simul 23(8):490–499
132. Li XJ et al (2009) Shape Transformations of membrane vesicles from amphiphilic triblock
copolymers: a dissipative particle dynamics simulation study. Macromolecules 42(8):3195–
3200
133. Li XJ (2013) Shape transformations of bilayer vesicles from amphiphilic block copolymers:
a dissipative particle dynamics simulation study. Soft Matter 9(48):11663–11670
134. Ortiz V et al (2005) Dissipative particle dynamics simulations of polymersomes. J Phys Chem
B 109(37):17708–17714
135. Darden T, York D, Pedersen L (1993) Particle mesh Ewald: An N·log (N) method for Ewald
sums in large systems. J Chem Phys 98(12), 10089–10092
136. Deserno M, Holm C (1998) How to mesh up Ewald sums. I. A theoretical and numerical
comparison of various particle mesh routines. J Chem Phys 109(18):7678–7693
137. Cisneros GA et al (2014) Classical electrostatics for biomolecular simulations. Chem Rev
114(1):779–814
138. Sindelka K et al (2014) Dissipative particle dynamics study of electrostatic self-assembly in
aqueous mixtures of copolymers containing one neutral water-soluble block and one either
positively or negatively charged polyelectrolyte block. Macromolecules 47(17):6121–6134
139. Sindelka K et al (2016) The electrostatic co-assembly in non-stoichiometric aqueous mixtures
of copolymers composed of one neutral water-soluble and one polyelectrolyte (either positively or negatively charged) block: a dissipative particle dynamics study. Phys Chem Chem
Phys 18(24):16137–16151
140. Peter EK, IV Pivkin (2014) A polarizable coarse-grained water model for dissipative particle
dynamics. J Chem Phys 141(16)
141. Peter EK, Lykov K, Pivkin IV (2015) A polarizable coarse-grained protein model for
dissipative particle dynamics. Phys Chem Chem Phys 17(37):24452–24461
142. Li NK et al (2015) Prediction of solvent-induced morphological changes of polyelectrolyte
diblock copolymer micelles. Soft Matter 11(42):8236–8245
143. Li NK, Fuss WH, Yingling YG (2015) An implicit solvent ionic strength (ISIS) method to
model polyelectrolyte systems with dissipative particle dynamics. Macromol Theory Simul
24(1):7–12
144. Li NK et al (2017) Salt responsive morphologies of ssDNA-based triblock polyelectrolytes in
semi-dilute regime: effect of volume fractions and polyelectrolyte length. Macromol Rapid
Commun 38(20)
145. Tang L et al (2014) Enzymatic polymerization of high molecular weight DNA amphiphiles
that self-assemble into star-like micelles. Adv Mater 26(19):3050–3054
146. Rodriguez-Hidalgo MD, Soto-Figueroa C, Vicente L (2013) Mesoscopic study of saltresponsive polymeric micelles: structural inversion mechanisms via sequential addition of
inorganic salts. Soft Matter 9(24):5762–5770
147. Wang D et al (2007) Purely salt-responsive micelle formation and inversion based on a
novel schizophrenic sulfobetaine block copolymer: Structure and kinetics of micellization.
Langmuir 23(23):11866–11874
99
126. Prhashanna A, Khan SA, Chen SB (2016) Kinetics of chain exchange between diblock
copolymer micelles. Macromol Theory Simul 25(4):383–391
127. Vishnyakov A, Lee MT, Neimark AV (2013) Prediction of the critical micelle concentration of
nonionic surfactants by dissipative particle dynamics simulations. J Phys Chem Lett 4(5):797–
802
128. Chansuna M, Pimpha N, Vao-soongnern V (2014) Mesoscale simulation and experimental
studies of self-assembly behavior of a PLA-PEG-PLA triblock copolymer micelle for
sustained drug delivery. J Polym Res 21(6)
129. He PT et al (2010) Complex micelles from the self-assembly of amphiphilic triblock
copolymers in selective solvents. J Chem Phys 132(20)
130. Huang JH, Fan ZX, Ma ZX (2013) Dissipative particle dynamics simulations on self-assembly
of rod-coil-rod triblock copolymers in a rod-selective solvent. J Chem Phys 139(6)
131. Zhou Y et al (2014) Dissipative particle dynamics simulation on self-assembly behavior of
rod-coil-rod triblock copolymer in solutions. Macromol Theory Simul 23(8):490–499
132. Li XJ et al (2009) Shape Transformations of membrane vesicles from amphiphilic triblock
copolymers: a dissipative particle dynamics simulation study. Macromolecules 42(8):3195–
3200
133. Li XJ (2013) Shape transformations of bilayer vesicles from amphiphilic block copolymers:
a dissipative particle dynamics simulation study. Soft Matter 9(48):11663–11670
134. Ortiz V et al (2005) Dissipative particle dynamics simulations of polymersomes. J Phys Chem
B 109(37):17708–17714
135. Darden T, York D, Pedersen L (1993) Particle mesh Ewald: An N·log (N) method for Ewald
sums in large systems. J Chem Phys 98(12), 10089–10092
136. Deserno M, Holm C (1998) How to mesh up Ewald sums. I. A theoretical and numerical
comparison of various particle mesh routines. J Chem Phys 109(18):7678–7693
137. Cisneros GA et al (2014) Classical electrostatics for biomolecular simulations. Chem Rev
114(1):779–814
138. Sindelka K et al (2014) Dissipative particle dynamics study of electrostatic self-assembly in
aqueous mixtures of copolymers containing one neutral water-soluble block and one either
positively or negatively charged polyelectrolyte block. Macromolecules 47(17):6121–6134
139. Sindelka K et al (2016) The electrostatic co-assembly in non-stoichiometric aqueous mixtures
of copolymers composed of one neutral water-soluble and one polyelectrolyte (either positively or negatively charged) block: a dissipative particle dynamics study. Phys Chem Chem
Phys 18(24):16137–16151
140. Peter EK, IV Pivkin (2014) A polarizable coarse-grained water model for dissipative particle
dynamics. J Chem Phys 141(16)
141. Peter EK, Lykov K, Pivkin IV (2015) A polarizable coarse-grained protein model for
dissipative particle dynamics. Phys Chem Chem Phys 17(37):24452–24461
142. Li NK et al (2015) Prediction of solvent-induced morphological changes of polyelectrolyte
diblock copolymer micelles. Soft Matter 11(42):8236–8245
143. Li NK, Fuss WH, Yingling YG (2015) An implicit solvent ionic strength (ISIS) method to
model polyelectrolyte systems with dissipative particle dynamics. Macromol Theory Simul
24(1):7–12
144. Li NK et al (2017) Salt responsive morphologies of ssDNA-based triblock polyelectrolytes in
semi-dilute regime: effect of volume fractions and polyelectrolyte length. Macromol Rapid
Commun 38(20)
145. Tang L et al (2014) Enzymatic polymerization of high molecular weight DNA amphiphiles
that self-assemble into star-like micelles. Adv Mater 26(19):3050–3054
146. Rodriguez-Hidalgo MD, Soto-Figueroa C, Vicente L (2013) Mesoscopic study of saltresponsive polymeric micelles: structural inversion mechanisms via sequential addition of
inorganic salts. Soft Matter 9(24):5762–5770
147. Wang D et al (2007) Purely salt-responsive micelle formation and inversion based on a
novel schizophrenic sulfobetaine block copolymer: Structure and kinetics of micellization.
Langmuir 23(23):11866–11874