395
12 Consensus Drug Design Using IT Microcosm
• Predicting the activity of mixtures that consist of several individual compounds
accounting for their quantitative composition and component synergism;
• Optimization of the qualitative and quantitative composition of compound mixtures with the aim of achieving the maximum pharmacological effect;
• Directed search for compounds that are highly selective for a certain biological
target subtype compared to other subtypes of the same target.
A general workflow of data processing in IT Microcosm is shown in Fig. 12.1. The
IT Microcosm software is available upon request. IT Microcosm White is a freely
Fig. 12.1  IT Microcosm workflow
Précédent

- 404/556

Suivant