Evolutionary Molecular Design in Virtual Fitness Landscapes
Gisbert Schneider · Methods and principles in medicinal chemistry · 2000
This chapter contains sections titled: Introduction De Novo Design is an Optimization Process An Evolution Strategy for Systematic Search in Chemical Space Structure of Chemical Space and the “Principle of Strong Causality” Spanning a Topological Pharmacophore Space for Similarity Searching Combinatorial Evolutionary Design of “Drug-Like” Molecules Conclusions