rdf-syntax-grammar
mods:
  schema location: http://www.loc.gov/mods/v3 http://www.loc.gov/standards/mods/v3/mods-3-2.xsd
  title info:
    title: Virtual screening for bioactive molecules
  name:
    name part: Böhm, Hans-Joachim.
  name:
    name part: Schneider, Gisbert
    name part: 1965-
  type of resource: text
  genre: bibliography
  genre: Electronic books.
  origin info:
    place:
      place term: gw
    place:
      place term: Weinheim
    place:
      place term: New York
    publisher: Wiley-VCH
    date issued: ©2000
    date issued: 2000
    issuance: monographic
  language:
    language term: eng
  physical description:
    form: remote
    extent: 1 online resource (xviii, 307 pages) : illustrations
  abstract: Recent progress in high-throughput screening, combinatorial chemistry and molecular biology has radically changed the approach to drug discovery in the pharmaceutical industry. New challenges in synthesis result in new analytical methods. At present, typically 100,000 to one million molecules have to be tested within a short period and, therefore, highly effective screening methods are necessary for today's researchers - preparing and characterizing one compound after another belongs to the past. Intelligent, computer-based search agents are needed and "virtual screening" provides so
  table of contents: High-throughput screening and virtual screening: entry points to drug discovery / Richard M. Eglen, Gisbert Schneider, Hans-Joachim Böhm -- Library filtering systems and prediction of drug-like properties / W. Patrick Walters, Mark A. Murcko -- Prediction of physicochemical properties / Jeff J. Morris, Pierre P. Bruneau -- Descriptor-based similarity measures for screening chemical databases / John M. Barnard, Geoffrey M. Downs, Peter Willett -- Modelling structure-activity relationships / Gianpaolo Bravi [and others] -- Database profiling by neural networks / Jens Sadowski -- Pharmacophore pattern application in virtual screening, library design and QSAR / Andrew C. Good, Jonathan S. Mason, Stephen D. Pickett -- Evolutionary molecular design in virtual fitness landscapes / Gisbert Schneider -- Practical approaches to evolutionary design / Lutz Weber -- Understanding receptor-ligand interactions as a prerequisite for virtual screening / Gerhard Klebe [and others] -- Structure-based library design / Martin Stahl -- The measurement of molecular diversity / Dimitris K. Agrafiotis [and others].
  note: edited by Hans-Joachim Böhm and Gisbert Schneider.
  note: Electronic reproduction. [Place of publication not identified] : HathiTrust Digital Library, 2010. MiAaHDL
  note: Master and use copy. Digital master created according to Benchmark for Faithful Digital Reproductions of Monographs and Serials, Version 1. Digital Library Federation, December 2002. http://purl.oclc.org/DLF/benchrepro0212 MiAaHDL
  note: digitized 2010 HathiTrust Digital Library committed to preserve pda MiAaHDL
  note: Includes bibliographical references and index.
  subject:
    topic: Drugs
    topic: Design
    topic: Computer simulation
  subject:
    topic: Drugs
    topic: Testing
    topic: Computer simulation
  subject:
    topic: Drugs
    topic: Design
  subject:
    topic: Structure-activity relationships (Biochemistry)
  subject:
    topic: Drug Design
  subject:
    topic: Databases, Factual
  subject:
    topic: Decision Making, Computer-Assisted
  subject:
    topic: Organic Chemicals
    topic: chemistry
  subject:
    topic: Structure-Activity Relationship
  classification: RS420 .V554 2000eb
  classification: 615.1900285
  classification: W1 ME9613H v.10 2000
  classification: QV 744 V819 2000
  classification: VC 6250
  classification: VK 8500
  related item:
    title info:
      title: Virtual screening for bioactive molecules
    origin info:
      publisher: Weinheim ; New York : Wiley-VCH, ©2000
    identifier: (DLC) 2001265029
  related item:
    title info:
      title: Methods and principles in medicinal chemistry ; v. 10
  identifier: 9783527613090
  identifier: 3527613099
  identifier: 9783527613083
  identifier: 3527613080
  identifier: 1282010352
  identifier: 9781282010352
  identifier: 9783527301539
  identifier: 3527301534
  identifier: 10.1002/9783527613083 Wiley InterScience
  identifier: http://proxy.library.tamu.edu/login
  record info:
    record content source: NhCcYBP
    record creation date: 090223
    record change date: 20260214210558.8
    record identifier: in00004689701
    language of cataloging:
      language term: eng