Inter- and Intramoleculer Interactions
There are different ways one can study intermolecular interactions, either through macroscopic approaches (dielectric continuum solvent models) to microscopic approaches. Here are some examples to explore how this can be done with the AMS program suite, including ADF, DFTB, MM and QUILD.
Energy Decomposition Analysis (EDA)
Solvent effects
Multi-level schemes
Biological systems