Burger's Medicinal Chemistry and Drug Discovery, Drug DiscoveryDonald J. Abraham Wiley, 2003 - 968 páginas This is Volume 1: Drug Discovery, of Burger's Medicinal Chemistry and Drug Discovery, 6th Edition. This new volume contains critical new chapters on Virtual Screening, Bioinformatics and Chemical Information Computing Systems in Drug Discovery. To purchase the entire 6 volume set, please refer to ISBN 0-471-37032-0. For a complete list of articles and contributors as well as FREE sample chapters from this new 6th Edition please visit: www.mrw.interscience.wiley.com/bmcdd |
Contenido
CHAPTER | 3 |
ISBN 0471270903 2003 John Wiley Sons | 31 |
HISTORY OF QUANTITATIVE 4 DRUGTARGET BINDING | 169 |
Derechos de autor | |
Otras 7 secciones no mostradas
Términos y frases comunes
acid active site affinity algorithm amino analogs analysis approach atoms binding mode Biochemistry bioinformatics Biol biological activity calculated Chem chemical shifts CO₂H combinatorial libraries complex compounds Comput Comput.-Aided Mol conformation crystal database derived descriptors developed diversity docking drug design drug discovery druglike electron electrostatic enantiomers enzyme enzyme inhibitors Equation example Figure fingerprints flexibility free energy functional groups gene H₂N Hansch hydrogen bonds hydrophobic identify inhibition inhibitors interac interactions K₁ large number library design ligand mass spectrometry Medicinal Chemistry methods molecular molecules optimization parameters peptide peptidomimetics pharmacophore phase potential predictive properties protease protein protein-ligand protons QSAR reactants reaction receptor residues ring sample scoring functions selection sequence similar solution solvent steric struc structure-based studies substituents substrate substructure target techniques three-dimensional tion tive ture types values virtual screening X-ray