Main Title |
Macromolecular structure and specificity : computer-assisted modeling and applications / |
Author |
Venkataraghavan, Babu. ;
Feldmann, Richard J.
|
Other Authors |
|
CORP Author |
New York Academy of Sciences. |
Publisher |
New York Academy of Sciences, |
Year Published |
1985 |
OCLC Number |
11814526 |
ISBN |
0897662733; 9780897662734; 0897662725; 9780897662727 |
Subjects |
Macromolecules--Data processing--Congresses ;
Computer Simulation ;
Macromolecular Substances ;
Models, Molecular
|
Additional Subjects |
Macromolecules--Data processing--Congresses
|
Internet Access |
|
Holdings |
Library |
Call Number |
Additional Info |
Location |
Last Modified |
Checkout Status |
EJEM |
Q11.N5 v.439 1985 |
|
OCSPP Chemical Library/Washington,DC |
10/28/1994 |
ELBM |
Q11.N5 v.439 |
|
AWBERC Library/Cincinnati,OH |
01/01/1988 |
|
Collation |
viii, 209 pages : illustrations (some color) ; 23 cm. |
Notes |
Papers presented at a conference which was held by New York Academy of Sciences on Oct. 12-14, 1983. Includes bibliographical references and index. |
Contents Notes |
Part 1 Topology and architecture of macromolecules -- Deduction of binding site structure from ligand binding data / Gordon M. Crippen -- Part 2 Computer-assisted macromolecular structure generation: extension of existing information -- On the construction of computer models of proteins by the extension of crystallographic structures / Richar J. Feldmann [and others] -- Protein structure and function by comparative model building / Jonathan Greer -- Generation of nucleic acid structures and binding of molecules to DNA / K.J. Miller [and others] -- Part 3 Molecular dynamics of macromolecules -- Molecular dynamics and minimum energy conformations of GnRH and analogs: a methodology for computer-aided drug design / R.S. Struthers, J. Rivier, A.T. Hagler -- Engineering aspects of protein structure / F.R. Salemme -- Dynamic aspects of protein structure / Martin Karplus -- Part 4 Applications of macromolecular specificity to drug design -- Modeling the mechanism of peptide cleavage by thermolysin / David G. Hangauer [and others] -- Design of anticancer drugs using modeling techniques / V.N. Balah [and others] -- Structure-activity studies: a three-dimensional probe of receptor specificity / Garland R. Marshall -- Part 5 Impact of computer hardware and graphics technology: future perspectives -- Calculations of the three-dimensional structures of proteins / Harold A. Scheraga -- A machine architecture for molecular dynamics: the systolic loop / Neil S. Ostlund, Robert A. Whiteside -- Papers presented at the conference but not submitted for publication: -- Part 1 -- The relevance of protein architecture to the design of new proteins / Jane S. Richardson -- Part 2 -- The use of one- and two-dimensional NMR spectroscopy to monitor the consequences of amino acid replacements in proteins / J.L. Markley [and others] -- Part 5 -- The future of molecular computer graphics or binding speed is of little use without illuminating interaction / Robert Langridge. |