Structural, Energetic, and Dynamic Aspects of Ligand–Receptor Interactions

Autor:	Domantas Motiejunas, Rebecca C. Wade
Rok vydání:	2007
Předmět:	Flexibility (engineering) Computational model Chemistry Computational chemistry Ligand (biochemistry)
Popis:	This chapter describes the physical factors contributing to ligand–receptor complexation and discusses the computational models of the energetics of ligand–receptor binding. Examples of the role of different interactions, as well as molecular flexibility, in ligand–receptor binding are provided and of how understanding these interactions can be exploited in structure-based ligand design.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::ba695b6b8fe3e6cf0e082e5ca987b648 https://doi.org/10.1016/b0-08-045044-x/00250-9 Zobrazit plný text záznamu