MARC record from Internet Archive

LEADER: 05078cam 2200709 a 4500
001 ocm32049713
003 OCoLC
005 20200108065317.0
008 950206s1995 dcua b 001 0 eng
010 $a 95001232
040 $aDLC$beng$cDLC$dAGL$dBAKER$dNLGGC$dBTCTA$dLVB$dYDXCP$dOCLCG$dBMU$dZWZ$dOKU$dOCLCQ$dOCLCF$dOCLCQ$dOCLCO$dOCL$dOCLCO$dOCLCQ$dGILDS$dNJR
020 $a0841231664$q(acid-free paper)
020 $a9780841231665$q(acid-free paper)
035 $a(OCoLC)32049713
050 00 $aQD39.3.E46$bP32 1995
070 0 $aQD1.A45$bno.592
072 0 $aX200
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082 00 $a542/.85/435$220
084 $a35.11$2bcl
245 00 $aParallel computing in computational chemistry :$bdeveloped from a symposium sponsored by the Division of Computers in Chemistry at the 207th National Meeting of the American Chemical Society, San Diego, California, March 13-17, 1994 /$cTimothy G. Mattson, editor.
260 $aWashington, DC :$bAmerican Chemical Society,$c1995.
300 $aviii, 222 pages :$billustrations ;$c24 cm.
336 $atext$btxt$2rdacontent
337 $aunmediated$bn$2rdamedia
338 $avolume$bnc$2rdacarrier
490 1 $aACS symposium series ;$v592
504 $aIncludes bibliographical references and indexes.
505 0 $aParallel computing / Timothy G. Mattson -- Parallel implementation of the electronic structure code GAMESS / Theresa L. Windus, Michael W. Schmidt, and Mark S. Gordon -- Applications of parallel GAMESS / Kim K. Baldridge, Mark S. Gordon, Jan H. Jensen, Nikita Matsunaga, Michael W. Schmidt, Theresa L. Windus, Jerry A. Boatz, and Thomas R. Cundari -- Object-oriented implementation of parallel ab initio programs / C.L. Janssen, E.T. Seidl, and M.E. Colvin -- Ab initio quantum chemistry on a workstation cluster / David P. Turner, Gary W. Trucks, and Michael J. Frisch -- The parallelization of a general ab initio multireference configuration interaction program : the COLUMBUS program system / Hans Lischka, Holger Dachsel, Ron Shepard, and Robert J. Harrison -- Parallel calculation of electron-transfer and resonance matrix elements of Hartree-Fock and generalized valence bond wave functions / Erik P. Bierwagen, Terry R. Coley, and William A. Goddard, III -- Promises and perils of parallel semiempirical quantum methods / Kim K. Baldridge -- Parallel molecular dynamics algorithms for simulation of molecular systems / Steve Plimpton and Bruce Hendrickson -- Portable molecular dynamics software for parallel computing / Timothy G. Mattson and Ganesan Ravishanker -- Advanced algorithms for molecular dynamics simulation : the program PMD / Andreas Windemuth -- Parallelization of Poisson-Boltzmann and Brownian dynamics calculations / Andrew Ilin, Babak Bagheri, L. Ridgway Scott, James M. Briggs, and J. Andrew McCammon -- Classical and quantum molecular dynamics simulation on distributed-memory massively parallel computers / Zhiming Li, R. Benny Gerber, and Craig C. Martens -- Biomolecular structure prediction using the double-iterated Kalman filter and neural networks / James A. Lupo, Ruth Pachter, Steven B. Fairchild, and W. Wade Adams.
650 0 $aChemistry$xData processing$vCongresses.
650 0 $aParallel processing (Electronic computers)$vCongresses.
650 6 $aChimie$xInformatique.
650 6 $aParalle lisme (Informatique)
650 7 $aChemistry$xData processing.$2fast$0(OCoLC)fst00853366
650 7 $aParallel processing (Electronic computers)$2fast$0(OCoLC)fst01052928
650 17 $aComputational chemistry.$2gtt
650 17 $aAb initio berekeningen.$2gtt
650 17 $aMoleculaire dynamica.$2gtt
650 7 $aChimie$xInformatique.$2ram
650 7 $aParalle lisme (informatique)$2ram
655 7 $aConference papers and proceedings.$2fast$0(OCoLC)fst01423772
655 4 $aCongresses.
700 1 $aMattson, Timothy G.,$d1958-
710 2 $aAmerican Chemical Society.$bDivision of Computers in Chemistry.
710 2 $aAmerican Chemical Society.$bMeeting$n(207th :$d1994 :$cSan Diego, Calif.)
776 08 $iOnline version:$tParallel computing in computational chemistry.$dWashington, DC : American Chemical Society, 1995$w(OCoLC)624464067
830 0 $aACS symposium series ;$v592.
856 41 $3Table of contents$uhttp://catdir.loc.gov/catdir/enhancements/fy0635/95001232-t.html
856 42 $3Publisher description$uhttp://catdir.loc.gov/catdir/enhancements/fy0635/95001232-d.html
856 41 $zFull text available from ACS Symposium Series (1974-2012)$uhttp://pubs.acs.org/doi/book/10.1021/bk-1995-0592$zRutgers restricted
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994 $aZ0$bP4A
948 $hNO HOLDINGS IN P4A - 190 OTHER HOLDINGS