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@article{DBLP:journals/jcamd/AlemanCG98,
author = {Carlos Alem{\'{a}}n and
Jordi Casanovas and
S{\'{e}}rgio Emanuel Galembeck},
title = {{PAPQMD} parametrization of molecular systems with cyclopropyl rings:
Conformational study of homopeptides constituted by 1-aminocyclopropane-1-carboxylic
acid},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {3},
pages = {259--273},
year = {1998},
url = {https://doi.org/10.1023/A:1007908630431},
doi = {10.1023/A:1007908630431},
timestamp = {Tue, 16 Nov 2021 00:00:00 +0100},
biburl = {https://dblp.org/rec/journals/jcamd/AlemanCG98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/BeckersMB98,
author = {Mischa L. M. Beckers and
Willem J. Melssen and
Lutgarde M. C. Buydens},
title = {Predicting nucleic acid torsion angle values using artificial neural
networks},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {53--61},
year = {1998},
url = {https://doi.org/10.1023/A:1007946620744},
doi = {10.1023/A:1007946620744},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/BeckersMB98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/BerglundRW98,
author = {Anders Berglund and
Maria Cristina De Rosa and
Svante Wold},
title = {Alignment of flexible molecules at their receptor site using 3D descriptors
and Hi-PCA},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {601--612},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/7/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/BerglundRW98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/BliznyukG98,
author = {Andrey A. Bliznyuk and
Jill E. Gready},
title = {Identification and energetic ranking of possible docking sites for
pterin on dihydrofolate reductase},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {325--333},
year = {1998},
url = {https://doi.org/10.1023/A:1008039000355},
doi = {10.1023/A:1008039000355},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/BliznyukG98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/Bohm98,
author = {Hans{-}Joachim B{\"{o}}hm},
title = {Prediction of binding constants of protein ligands: {A} fast method
for the prioritization of hits obtained from de novo design or 3D
database search programs},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {309--323},
year = {1998},
url = {https://doi.org/10.1023/A:1007999920146},
doi = {10.1023/A:1007999920146},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/Bohm98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/BostromNL98,
author = {Jonas Bostr{\"{o}}m and
Per{-}Ola Norrby and
Tommy Liljefors},
title = {Conformational energy penalties of protein-bound ligands},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {383--396},
year = {1998},
url = {https://doi.org/10.1023/A:1008007507641},
doi = {10.1023/A:1008007507641},
timestamp = {Mon, 26 Oct 2020 00:00:00 +0100},
biburl = {https://dblp.org/rec/journals/jcamd/BostromNL98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/BrunoCLRTV98,
author = {Ian J. Bruno and
Jason C. Cole and
Jos P. M. Lommerse and
R. Scott Rowland and
Robin Taylor and
Marcel L. Verdonk},
title = {IsoStar: {A} library of information about nonbonded interactions},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {525--537},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/5/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/BrunoCLRTV98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/Carlacci98,
author = {Louis Carlacci},
title = {Conformational analysis of [Met5]-enkephalin: Solvation and ionization
considerations},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {195--213},
year = {1998},
url = {https://doi.org/10.1023/A:1007993118927},
doi = {10.1023/A:1007993118927},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/Carlacci98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/CentenoP98,
author = {Nuria B. Centeno and
Juan Jes{\'{u}}s P{\'{e}}rez},
title = {A proposed bioactive conformation of Peptide {T}},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {7--14},
year = {1998},
url = {https://doi.org/10.1023/A:1007994502997},
doi = {10.1023/A:1007994502997},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/CentenoP98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/CzaplewskiKC98,
author = {Cezary Czaplewski and
Rajmund Kazmierkiewicz and
Jerzy Ciarkowski},
title = {Molecular modeling of the human vasopressin {V2} receptor/agonist
complex},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {3},
pages = {275--287},
year = {1998},
url = {https://doi.org/10.1023/A:1007969526447},
doi = {10.1023/A:1007969526447},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/CzaplewskiKC98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/DuM98,
author = {Qishi Du and
Paul G. Mezey},
title = {Heuristic lipophilicity potential for computer-aided rational drug
design: Optimizations of screening functions and parameters},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {451--470},
year = {1998},
url = {https://doi.org/10.1023/A:1008040309114},
doi = {10.1023/A:1008040309114},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/DuM98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/FilikovJ98,
author = {Anton V. Filikov and
Thomas L. James},
title = {Structure-based design of ligands for protein basic domains: Application
to the {HIV-1} Tat protein},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {3},
pages = {229--240},
year = {1998},
url = {https://doi.org/10.1023/A:1007949625270},
doi = {10.1023/A:1007949625270},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/FilikovJ98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/FilizolaPC98,
author = {Marta Filizola and
Juan Jes{\'{u}}s P{\'{e}}rez and
Maria Carten{\`{\i}}{-}Farina},
title = {{BUNDLE:} {A} program for building the transmembrane domains of G-protein-coupled
receptors},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {111--118},
year = {1998},
url = {https://doi.org/10.1023/A:1007969112988},
doi = {10.1023/A:1007969112988},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/FilizolaPC98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/FossaBM98,
author = {Paola Fossa and
Raffaella Boggia and
Luisa Mosti},
title = {Toward the identification of the cardiac cGMP inhibited-phosphodiesterase
catalytic site},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {361--372},
year = {1998},
url = {https://doi.org/10.1023/A:1007928412086},
doi = {10.1023/A:1007928412086},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/FossaBM98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/GaudioTR98,
author = {Anderson Coser Gaudio and
Yuji Takahata and
William Graham Richards},
title = {Prediction of the binding mode of N2-phenylguanine derivative inhibitors
to herpes simplex virus type 1 thymidine kinase},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {15--25},
year = {1998},
url = {https://doi.org/10.1023/A:1007930523818},
doi = {10.1023/A:1007930523818},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/GaudioTR98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/Gerber98,
author = {Paul R. Gerber},
title = {Charge distribution from a simple molecular orbital type calculation
and non-bonding interaction terms in the force field {MAB}},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {37--51},
year = {1998},
url = {https://doi.org/10.1023/A:1007902804814},
doi = {10.1023/A:1007902804814},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/Gerber98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/GrootHVZVL98,
author = {Marcel J. de Groot and
Remco W. A. Havenith and
H. Maarten Vinkers and
Renate Zwaans and
Nico P. E. Vermeulen and
Joop H. van Lenthe},
title = {Ab initio calculations on iron-porphyrin model systems for intermediates
in the oxidative cycle of cytochrome P450s},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {183--193},
year = {1998},
url = {https://doi.org/10.1023/A:1007971918536},
doi = {10.1023/A:1007971918536},
timestamp = {Sat, 30 Sep 2023 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/GrootHVZVL98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/HanssonMA98,
author = {Tomas Hansson and
John Marelius and
Johan {\AA}qvist},
title = {Ligand binding affinity prediction by linear interaction energy methods},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {27--35},
year = {1998},
url = {https://doi.org/10.1023/A:1007930623000},
doi = {10.1023/A:1007930623000},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/HanssonMA98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/HenriquesRR98,
author = {Elsa F. Henriques and
Maria Jo{\~{a}}o Ramos and
Christopher A. Reynolds},
title = {Inclusion of conserved buried water molecules in the model structure
of rat submaxillary kallikrein},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {547--556},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/3/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/HenriquesRR98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/JufferV98,
author = {Andr{\'{e}} H. Juffer and
Hans J. Vogel},
title = {A flexible triangulation method to describe the solvent-accessible
surface of biopolymers},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {3},
pages = {289--299},
year = {1998},
url = {https://doi.org/10.1023/A:1016089901704},
doi = {10.1023/A:1016089901704},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/JufferV98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/KingS98,
author = {Ross D. King and
Ashwin Srinivasan},
title = {The discovery of indicator variables for {QSAR} using inductive logic
programming},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {571--580},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/2/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/KingS98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/LemmenHL98,
author = {Christian Lemmen and
Claus Hiller and
Thomas Lengauer},
title = {RigFit: {A} new approach to superimposing ligand molecules},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {491--502},
year = {1998},
url = {https://doi.org/10.1023/A:1008027706830},
doi = {10.1023/A:1008027706830},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/LemmenHL98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/Lopez-RodriguezMBR98,
author = {Mar{\'{\i}}a L. L{\'{o}}pez{-}Rodr{\'{\i}}guez and
Mar{\'{\i}}a Jos{\'{e}} Morcillo and
Bellinda Benham{\'{u}} and
Mar{\'{\i}}a Luisa Rosado},
title = {Comparative receptor mapping of serotoninergic 5-HT3 and 5-HT4 binding
sites},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {589--599},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/8/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/Lopez-RodriguezMBR98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/MareliusGHHA98,
author = {John Marelius and
Malin Graffner{-}Nordberg and
Tomas Hansson and
Anders Hallberg and
Johan {\AA}qvist},
title = {Computation of affinity and selectivity: Binding of 2, 4-diaminopteridine
and 2, 4-diaminoquinazoline inhibitors to dihydrofolate reductases},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {119--131},
year = {1998},
url = {https://doi.org/10.1023/A:1007929626986},
doi = {10.1023/A:1007929626986},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/MareliusGHHA98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/MeyerWKS98,
author = {Michael Meyer and
Gerd Wohlfahrt and
J{\"{o}}rg Kn{\"{a}}blein and
Dietmar Schomburg},
title = {Aspects of the mechanism of catalysis of glucose oxidase: {A} docking,
molecular mechanics and quantum chemical study},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {425--440},
year = {1998},
url = {https://doi.org/10.1023/A:1008020124326},
doi = {10.1023/A:1008020124326},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/MeyerWKS98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/MullerG98,
author = {Gerhard M{\"{u}}ller and
Henry Giera},
title = {Protein secondary structure templates derived from bioactive natural
products - Combinatorial chemistry meets structure-based design},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {1--6},
year = {1998},
url = {https://doi.org/10.1023/A:1007954801605},
doi = {10.1023/A:1007954801605},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/MullerG98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/MurrayAE98,
author = {Christopher W. Murray and
Timothy R. Auton and
Matthew D. Eldridge},
title = {Empirical scoring functions. {II.} The testing of an empirical scoring
function for the prediction of ligand-receptor binding affinities
and the use of Bayesian regression to improve the quality of the model},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {503--519},
year = {1998},
url = {https://doi.org/10.1023/A:1008040323669},
doi = {10.1023/A:1008040323669},
timestamp = {Mon, 26 Oct 2020 00:00:00 +0100},
biburl = {https://dblp.org/rec/journals/jcamd/MurrayAE98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/NilssonHSGW98,
author = {Jonas Nilsson and
Evert J. Homan and
Age K. Smilde and
Cor J. Grol and
H{\aa}kan Wikstr{\"{u}}m},
title = {A multiway 3D {QSAR} analysis of a series of (S)-N-[(1-ethyl-2-pyrrolidinyl)methyl]-6-methoxybenzamides},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {81--93},
year = {1998},
url = {https://doi.org/10.1023/A:1007977010551},
doi = {10.1023/A:1007977010551},
timestamp = {Sun, 02 Oct 2022 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/NilssonHSGW98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/OvaskaY98,
author = {Martti Ovaska and
Ari Yliniemel{\"{a}}},
title = {A semiempirical study on inhibition of catechol O-methyltransferase
by substituted catechols},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {3},
pages = {301--307},
year = {1998},
url = {https://doi.org/10.1023/A:1007965026738},
doi = {10.1023/A:1007965026738},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/OvaskaY98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/ParksCT98,
author = {Camden A. Parks and
Gordon M. Crippen and
John G. Topliss},
title = {The measurement of molecular diversity by receptor site interaction
simulation},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {441--449},
year = {1998},
url = {https://doi.org/10.1023/A:1008023429373},
doi = {10.1023/A:1008023429373},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/ParksCT98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/PaulinoEVTET98,
author = {Margot Paulino and
A. Esteves and
M. Vega and
G. Tabares and
R. Ehrlich and
O. Tapia},
title = {Modelling a 3D structure for EgDf1 from shape Echinococcus granulosus:
putative epitopes, phosphorylation motifs and ligand},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {351--360},
year = {1998},
url = {https://doi.org/10.1023/A:1007938710249},
doi = {10.1023/A:1007938710249},
timestamp = {Mon, 14 Jun 2021 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/PaulinoEVTET98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/PetitBCPT98,
author = {Samuel Petit and
Fr{\'{e}}d{\'{e}}ric Brard and
G{\'{e}}rard Coquerel and
Guy Perez and
Fran{\c{c}}ois Tron},
title = {Structural models of antibody variable fragments: {A} method for investigating
binding mechanisms},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {147--163},
year = {1998},
url = {https://doi.org/10.1023/A:1007937823079},
doi = {10.1023/A:1007937823079},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/PetitBCPT98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/PoirretteARW98,
author = {Andrew R. Poirrette and
Peter J. Artymiuk and
David W. Rice and
Peter Willett},
title = {Comparison of protein surfaces using a genetic algorithm},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {557--569},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/6/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/PoirretteARW98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/RadmerK98,
author = {Randall J. Radmer and
Peter A. Kollman},
title = {The application of three approximate free energy calculations methods
to structure based ligand design: Trypsin and its complex with inhibitors},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {3},
pages = {215--227},
year = {1998},
url = {https://doi.org/10.1023/A:1007905722422},
doi = {10.1023/A:1007905722422},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/RadmerK98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/RareyD98,
author = {Matthias Rarey and
J. Scott Dixon},
title = {Feature trees: {A} new molecular similarity measure based on tree
matching},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {471--490},
year = {1998},
url = {https://doi.org/10.1023/A:1008068904628},
doi = {10.1023/A:1008068904628},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/RareyD98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/SongPHYR98,
author = {Jin{-}Soo Song and
Heungrok Park and
Hyo{-}Jeong Hong and
Myeong{-}Hee Yu and
Seong{-}Eon Ryu},
title = {Homology modeling of the receptor binding domain of human thrombopoietin},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {419--424},
year = {1998},
url = {https://doi.org/10.1023/A:1008064228464},
doi = {10.1023/A:1008064228464},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/SongPHYR98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/SuleaKOS98,
author = {Traian Sulea and
Ludovic Kurunczi and
Tudor I. Oprea and
Zeno Simon},
title = {{MTD-ADJ:} {A} multiconformational minimal topologic difference for
determining bioactive conformers using adjusted biological activities},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {133--146},
year = {1998},
url = {https://doi.org/10.1023/A:1007913622673},
doi = {10.1023/A:1007913622673},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/SuleaKOS98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/SwaanSO98,
author = {Peter W. Swaan and
Francis C. Szoka Jr. and
Svein {\O}ie},
title = {Molecular modeling of the intestinal bile acid carrier: {A} comparative
molecular field analysis study},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {581--588},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/1/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/SwaanSO98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/TodorovD98,
author = {Nikolay P. Todorov and
Philip M. Dean},
title = {A branch-and-bound method for optimal atom-type assignment in de novo
ligand design},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {335--349},
year = {1998},
url = {https://doi.org/10.1023/A:1007994827087},
doi = {10.1023/A:1007994827087},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/TodorovD98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/TomicGKW98,
author = {Sanja Tomic and
Razif R. Gabdoulline and
Biserka Kojic{-}Prodic and
Rebecca C. Wade},
title = {Classification of auxin plant hormones by interaction property similarity
indices},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {1},
pages = {63--79},
year = {1998},
url = {https://doi.org/10.1023/A:1007973008558},
doi = {10.1023/A:1007973008558},
timestamp = {Sat, 30 Sep 2023 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/TomicGKW98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/TonmunpheanKPWWLR98,
author = {Somsak Tonmunphean and
Sirirat Kokpol and
Vudhichai Parasuk and
Peter Wolschann and
Rudolf H. Winger and
Klaus R. Liedl and
Bernd M. Rode},
title = {Comparative molecular field analysis of artemisinin derivatives: Ab
initio versus semiempirical optimized structures},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {397--409},
year = {1998},
url = {https://doi.org/10.1023/A:1008002602653},
doi = {10.1023/A:1008002602653},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/TonmunpheanKPWWLR98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/TroconisMNM98,
author = {Mary Troconis and
Wenwen Ma and
David E. Nichols and
Jerry McLaughlin},
title = {Molecular modeling study of tubulosine and other related ipecac alkaloids},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {5},
pages = {411--418},
year = {1998},
url = {https://doi.org/10.1023/A:1008019720578},
doi = {10.1023/A:1008019720578},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/TroconisMNM98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/VazMP98,
author = {Roy J. Vaz and
Larry R. McLean and
John T. Pelton},
title = {Evaluation of proposed modes of binding of (2S)-2-[4-[[(3S)-1-acetimidoyl-3-pyrrolidinyl]oxy]phenyl]-3-(7-amidino-2-naphthyl)propanoic
acid hydrochloride and some analogs to Factor Xa using a comparative
molecular field analysis},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {99--110},
year = {1998},
url = {https://doi.org/10.1023/A:1007969517376},
doi = {10.1023/A:1007969517376},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/VazMP98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/VenkateswarluL98,
author = {Divi Venkateswarlu and
Jerzy Leszczynski},
title = {Tautomeric equilibria in 8-oxopurines: Implications for mutagenicity},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {4},
pages = {373--382},
year = {1998},
url = {https://doi.org/10.1023/A:1008067110965},
doi = {10.1023/A:1008067110965},
timestamp = {Sat, 30 May 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/VenkateswarluL98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/WalkerKDG98,
author = {Wynn L. Walker and
Mary L. Kopka and
Richard E. Dickerson and
David S. Goodsell},
title = {Design of stapled DNA-minor-groove-binding molecules with a mutable
atom simulated annealing method},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {6},
pages = {539--546},
year = {1998},
url = {http://ipsapp007.lwwonline.com/content/getfile/4830/3/4/abstract.htm},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/WalkerKDG98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/WoolfreyAD98,
author = {John R. Woolfrey and
Mitchell A. Avery and
Arthur M. Doweyko},
title = {Comparison of 3D quantitative structure-activity relationship methods:
Analysis of the in vitro antimalarial activity of 154 artemisinin
analogues by hypothetical active-site lattice and comparative molecular
field analysis},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {2},
pages = {165--181},
year = {1998},
url = {https://doi.org/10.1023/A:1007967517859},
doi = {10.1023/A:1007967517859},
timestamp = {Thu, 16 Apr 2020 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/WoolfreyAD98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcamd/ZuccottoMLTG98,
author = {Fabio Zuccotto and
Andrew C. R. Martin and
Roman A. Laskowski and
Janet M. Thornton and
Ian H. Gilbert},
title = {Dihydrofolate reductase: {A} potential drug target in trypanosomes
and leishmania},
journal = {J. Comput. Aided Mol. Des.},
volume = {12},
number = {3},
pages = {241--257},
year = {1998},
url = {https://doi.org/10.1023/A:1016085005275},
doi = {10.1023/A:1016085005275},
timestamp = {Fri, 09 Apr 2021 01:00:00 +0200},
biburl = {https://dblp.org/rec/journals/jcamd/ZuccottoMLTG98.bib},
bibsource = {dblp computer science bibliography, https://dblp.org}
}
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