000			03344nam a2200517 i 4500
005			20250919090743.0
006			m eo d
007			cr cn |||m|||a
008			170323s2013 enka ob 001 0 eng d
020			_z9781909453029 (print)
020			_a9781909453005 (ePub)
020			_a9781909453012 (eISBN)
024	7		_a10.4155/9781909453012 _2doi
035			_a(LOFM)9781909453012
039		9	_y03-23-2017 _zafifah
040			_dUKM
090			_aebook PHCTM
245	0	0	_aIn silico drug discovery and design / _ceditor, Markus A. Lill.
264		1	_aLondon, England : _bFuture Science Ltd, _c[2013].
300			_a1 PDF (224 pages) : _bcolor illustrations, digital file.
336			_atext _2rdacontent
337			_acomputer _2rdamedia
338			_aonline resource _2rdacarrier
490	1		_aThe Future Science Group eBook collection, _x2047-332X
500			_aPage 224 is blank.
504			_aIncludes bibliographical references and index.
505	0		_aIn 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.
506			_aRestricted to subscribers or individual electronic text purchasers.
530			_aAlso available in print.
538			_aSystem requirements: Adobe Acrobat Reader.
538			_aMode of access: World Wide Web.
588			_aTitle from PDF title page (Future Science eBooks Web site, viewed November 18, 2013).
650	1	2	_aDrug Discovery _xmethods.
655		0	_aElectronic books.
700	1		_aLill, Markus A., _eeditor.
710	2		_aFuture Science Ltd., _epublisher.
776	0	8	_iPrint version: _z9781909453029
830		0	_aFuture Science Group eBook collection, _x2047-332X.
856	4	0	_uhttps://doi.org/10.4155/9781909453012
856	4	0	_uhttps://doi-org.eresourcesptsl.ukm.remotexs.co/10.4155/9781909453012
907			_a.b16453189 _b2023-06-28 _c2019-11-12
942			_n0 _kebook PHCTM
914			_avtls003619822
998			_ah _b2017-10-03 _cm _dz _feng _genk _y0 _z.b16453189
999			_c618469 _d618469