An Insight into molecular structure and properties of flexible amorphous polymers: A molecular dynamics simulation approach

Volume: 136, Issue: 18, Pages: 47457 - 47457
Published: Jan 10, 2019
Abstract
Visualization of polymer molecules by molecular dynamics simulation remains a challenging area in molecular modeling, as it involves a number of factors like type of force field, simulation time, simulation steps, and so forth. In our present study, we have used the condensed-phase optimized molecular potentials for atomistic simulation studies (COMPASS) force field, which is specific for polymers and organic molecules, in order to visualize the...
Paper Details
Title
An Insight into molecular structure and properties of flexible amorphous polymers: A molecular dynamics simulation approach
Published Date
Jan 10, 2019
Volume
136
Issue
18
Pages
47457 - 47457
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