Construction of a Novel Doxorubicin Nanomedicine Using Bindarit as a Carrier: A Multiscale Computer Simulation-Assisted Design-Based Study

Figure 4

DPD mesoscopic simulation. (a) The kinect mesostructure of complex of DOX/BIN during DPD simulation from 0 to 50000 ps (red is DOX, green is BIN). (b) Kinetic energy change from 0 to 10000 ps; the figure below shows the enlargement of 0–1000 ps. (c) Potential energy change from 0 to 10000 ps; the figure below shows the enlargement of 0–1000 ps. (d) Nonbond energy change from 0 to 10000 ps; the figure below shows the enlargement of 0–1000 ps.

(a)

(b)

(c)

(d)