Computational Drug Design || Molecular Mechanics

✍ Scribed by Young, David C.

• Book ID: 121014934
• Publisher: John Wiley & Sons, Inc.
• Year: 2009
• Tongue: English
• Weight: 127 KB
• Edition: 1
• Category: Article
• ISBN: 047012685X
• DOI: 10.1002/9780470451854.ch10

✦ Synopsis

Introduction -- Properties That Make A Molecule A Good Drug -- Target Identification -- Target Characterization -- The Drug Design Process For A Known Protein Target -- The Drug Design Process For An Unknown Target -- Drug Design For Other Targets -- Compound Library Design -- Computational Tools And Techniques -- Homology Model Building -- Molecular Mechanics -- Protein Folding -- Docking -- Pharmacophore Models -- Qsar -- 3d-qsar -- Quantum Mechanics In Drug Design -- De Novo And Other Ai Techniques -- Cheminformatics -- Admet -- Multiobjective Optimization -- Automation Of Tasks -- Bioinformatics -- Simulations At The Cellular And Organ Level -- Synthesis Route Prediction -- Proteomics -- Prodrug Approaches -- Future Developments In Drug Design. David C. Young. Includes Bibliographical References And Index.