Molecular modeling encompasses all methods, theoretical and computational, used to model or mimic the behavior of molecules. The methods are used in the fields of computational chemistry, drug design, computational biology and materials science to study molecular systems ranging from small chemical systems to large biological molecules and material assemblies. The simplest calculations can be performed by hand, but inevitably computers are required to perform molecular modeling of any reasonably sized system. The common feature of molecular modeling methods is the atomistic level description of the molecular systems.
- Molecular docking
- Differential processing in modality-specific Mauthner cell dendrites.
- Molecular Modelling of Peptide-Based Materials for Biomedical Applications.
- Formal Models of Biological Systems.