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Drug Design and Molecular Dynamics by AlejandraVásquezHernández is a document available to read on EtoBox.

The document contains lecture notes for a class on analyzing biomolecular and cellular systems. It discusses refining computational models of protein structures using techniques like energy minimization and molecular dynamics. It also covers calculating changes in free energy for small molecule drugs and how they are designed through analog-based methods or structure-based docking to target proteins. Key considerations for identifying good drug candidates include following Lipinsky

Author
AlejandraVásquezHernández
Language
EN