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: Rational drug design
    sub title: novel methodology and practical applications
  name:
    name part: Parrill, Abby L.
  name:
    name part: Rami Reddy, M.
  name:
    name part: American Chemical Society
    name part: Division of Computers in Chemistry.
  name:
    name part: American Chemical Society
    name part: Meeting
    name part: (214th : 1997 : Las Vegas, Nev.)
  type of resource: text
  genre: bibliography
  genre: conference publication
  genre: Electronic books.
  genre: Congress
  genre: proceedings (reports)
  genre: Conference papers and proceedings
  genre: Conference papers and proceedings.
  genre: Actes de congrès.
  origin info:
    place:
      place term: dcu
    place:
      place term: Washington, DC
    publisher: American Chemical Society
    date issued: ©1999
    date issued: 1999
    issuance: monographic
  language:
    language term: eng
  physical description:
    form: remote
    extent: 1 online resource (x, 374 pages) : illustrations
  table of contents: Overview of rational drug design / M. Rami Reddy and Abby L. Parrill -- Conformational and energetic aspects of receptor-ligand recognition / J.D. Hirst, B. Dominy, Z. Guo, M. Vieth, and C.L. Brooks -- New free energy calculation methods for structure-based drug design and prediction of protein stability / Lu Wang, Mats A.L. Eriksson, Jed Pitera, and Peter A. Kollman -- Binding evaluation using the finite difference solution to the linearized Poisson-Boltzmann equation and solvation entropy correction / Jian Shen -- SmoG, a ligand design method based on knowledge-based parametrization of a solvent reorganization model / Robert S. DeWitte and Eugene I. Shakhnovich -- The evaluation of multi-body dynamics for studying ligand-protein interactions : using MBO(N)D to probe the unbinding pathways of Cbz-Val-Phe-Phe-Val-Cbz from the active site of HIV-1 protease / Donovan Chin, David N. Haney, Katya Delak, Hon M. Chun, and Carlos E. Padilla -- Calculation of relative hydration free energy differences for heteroaromatic compounds : use in the design of AMP deaminase inhibitors / Mark D. Erion and M. Rami Reddy -- New tools for rational drug design / Gregory D. Hawkins, Jiabo Li, Tianhai (Tony) Zhu, Candee C. Chambers, David J. Giesen, Daniel A. Liotard, Christopher J. Cramer, and Donald G. Truhlar -- Rational Approaches to inhibition of human osteoclast cathepsin K and treatment of osteoporosis / Sherin S. Abdel-Meguid, Baoguang Zhao, Ward W. Smith, Cheryl A. Hanson, Judith LaLonde, Thomas Carr, Karla D'Alessio, Michael S. McQueney, H.-J. Oh, Scott K. Thompson, Daniel F. Veber, and Dennis S. Yamashita -- Building a hypothesis for nucleotide transport inhibitors / K. Raghavan, Scott D. Kahn, and John K. Buolamwini -- Unified pharmacophoric model for cannabinoids and aminoalkylindoles derived from molecular superimposition of CB₁ cannabinoid receptor agonists CP55244 and WIN55212-2 / Joong-Youn Shim, Elizabeth R. Collantes, William J. Welsh, and Allyn C. Howlett -- Structure-…
  note: Abby L. Parrill, editor, M. Rami Reddy, editor.
  note: Title from PDF title page (ACS publications, viewed August 24, 2009).
  note: "Developed from a symposium sponsored by the Division of Computers in Chemistry at the 214th National Meeting of the American Chemical Society, Las Vegas, Nevada, September 7-12, 1997."
  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 indexes.
  note: English.
  subject:
    topic: Drugs
    topic: Design
    genre: Congresses
  subject:
    topic: Drugs
    topic: Structure-activity relationships
    genre: Congresses
  subject:
    topic: Combinatorial chemistry
    genre: Congresses
  subject:
    topic: Drugs
    topic: Design
  subject:
    topic: Drugs
    topic: Design
    topic: Congresses
  subject:
    topic: Drugs
    topic: Structure-activity relationships
    topic: Congresses
  subject:
    topic: Combinatorial chemistry
    topic: Congresses
  subject:
    topic: Drug Design
  subject:
    topic: Computer Simulation
  subject:
    topic: Médicaments
    topic: Conception
    topic: Congrès
  subject:
    topic: Médicaments
    topic: Relations structure-activité
    topic: Congrès
  subject:
    topic: Chimie combinatoire
    topic: Congrès
  subject:
    topic: Médicaments
    topic: Conception
    genre: Congrès
  subject:
    topic: Médicaments
    topic: Relations structure-activité
    genre: Congrès
  subject:
    topic: Chimie combinatoire
    genre: Congrès
  subject:
    topic: Médicaments
    topic: Conception
  subject:
    topic: Simulation par ordinateur
  subject:
    topic: simulation
  subject:
    topic: MEDICAL
    topic: Pharmacology
  subject:
    topic: Combinatorial chemistry
  subject:
    topic: Drugs
    topic: Design
  subject:
    topic: Drugs
    topic: Structure-activity relationships
  subject:
    topic: Arzneimitteldesign
  subject:
    topic: Kongress
  subject:
    topic: Médicaments
    topic: Relation structure-activité
  subject:
    topic: Chimie combinatoire
  subject:
    topic: Médicaments
    topic: Conception
  subject:
    topic: rational drug design
  subject:
    topic: ACS
  subject:
    topic: computers
  subject:
    topic: chemistry
  classification: RS420 .R37 1999
  classification: 615/.19
  classification: 1999 G-207
  classification: QV 744 R236 1999
  classification: VS 5358
  related item:
    title info:
      title: Rational drug design
    origin info:
      publisher: Washington, DC : American Chemical Society, ©1999
    identifier: (DLC) 98032087
    identifier: (OCoLC)40311446
  related item:
    title info:
      title: ACS symposium series ; 719
  identifier: 9780841217072
  identifier: 0841217076
  identifier: 0841236038
  identifier: 9780841236035
  identifier: http://proxy.library.tamu.edu/login
  record info:
    record content source: MUU
    record creation date: 090824
    record change date: 20241009195848.0
    record identifier: in00005505664
    language of cataloging:
      language term: eng