TY  - BOOK
AU  - Lill,Markus A.
ED  - Future Science Ltd.,
TI  - In silico drug discovery and design
T2  - The Future Science Group eBook collection,
PY  - 2013///]
CY  - London, England
PB  - Future Science Ltd
KW  - Drug Discovery
KW  - methods
KW  - Electronic books
N1  - Page 224 is blank; Includes bibliographical references and index; In silico drug discovery and design / Markus A. Lill -- Molecular docking and structure-based virtual screening / Chenzhong Liao, Megan L. Peach, Risheng Yao & Marc C Nicklaus -- Computational fragment-based drug design / Gregory Sliwoski & Edward W. Lowe Jr. -- Comparative modeling and structure prediction : application to drug discovery / Emidio Capriotti -- Advances in molecular dynamics simulations and free-energy calculations relevant for drug design / Nadine Homeyer & Holger Gohlke -- Quantum mechanical applications in drug discovery / Michael P. Mazanetz -- Pharmacophore modeling / Stefan M. Noha & Daniela Schuster -- QSAR in the new millennium / Vijay M. Khedkar & Evans C. Coutinho -- Receptor-dependent QSAR methods / Xialan Dong & Weifan Zheng -- Computational methods based on molecular shape / Elisabet Gregori-Puigjan-- Machine learning and similarity-based virtual screening techniques / J✹gen Bajorath -- In silico absorption, distribution, metabolism and excretion / Prashant S. Kharkar -- Computational models for toxicity prediction / Sandhya Kortagere -- Computational methods for drug target profiling and polypharmacology / Thierry Langer & Sharon D. Bryant -- Integrating structure-and ligand-based approaches for computer-aided drug design / Gregory L. Wilson & Markus A. Lill -- Binding site identification in target proteins / Yi Xiong, Xiaolei Zhu & Daisuke Kihara -- Index; Restricted to subscribers or individual electronic text purchasers; Also available in print
UR  - https://doi.org/10.4155/9781909453012  
UR  - https://doi-org.eresourcesptsl.ukm.remotexs.co/10.4155/9781909453012
ER  -