Molecular Dynamics Simulations of PAMAM and PPI Dendrimers Using the GROMOS-Compatible 2016H66 Force Field.
Mayk C. RamosVitor A. C. HortaBruno A. C. HortaPublished in: J. Chem. Inf. Model. (2019)
Keyphrases
- force field
- molecular dynamics simulations
- molecular dynamics
- protein protein interactions
- active contours
- active contour model
- deformable models
- gradient vector flow
- information theory
- vector field
- object boundaries
- scientific data
- gradient field
- three dimensional
- information theoretic
- image gradient
- level set
- data analysis