Multi-scale-Modeling

Models for predicting the internal disposition of chemicals and materials at multiple scales, including pharmacokinetics and biodistribution studies.

Models

Parametrization of DPD Models using the Groot - De Warren Approach

A web application for the parametrization of Dissipative Particle Dynamics (DPD) models using the Groot-De Warren methodology. Based on the reference: 'Dissipative particle dynamics: Bridging the gap between atomistic and mesoscopic simulation' (J. Chem. Phys. DOI:10.1063/1.474784).

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