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100917s2011 xxu| s |||| 0|eng d |
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|a 9781607618393
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| 024 |
7 |
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|a 10.1007/978-1-60761-839-3
|2 doi
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| 040 |
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|a Sistema de Bibliotecas del Tecnológico de Costa Rica
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| 245 |
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|a Chemoinformatics and Computational Chemical Biology /
|c edited by Jürgen Bajorath.
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| 250 |
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|a 1st ed. 2011.
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| 260 |
# |
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|a Totowa, NJ :
|b Humana Press :
|b Imprint: Humana,
|c 2011.
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| 300 |
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|a X, 588 p. 150 illus., 13 illus. in color. :
|b online resource.
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| 336 |
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|a text
|b txt
|2 rdacontent
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| 337 |
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|a computer
|b c
|2 rdamedia
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| 338 |
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|a online resource
|b cr
|2 rdacarrier
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| 490 |
1 |
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|a Methods in Molecular Biology,
|v 672
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| 505 |
0 |
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|a Some Trends in Chem(o)informatics -- Molecular Similarity Measures -- The Ups and Downs of Structure-Activity Landscapes -- Computational Analysis of Activity and Selectivity Cliffs -- Similarity Searching Using 2D Structural Fingerprints -- Predicting the Performance of Fingerprint Similarity Searching -- Bayesian Methods in Virtual Screening and Chemical Biology -- Reduced Graphs and Their Applications in Chemoinformatics -- Fragment Descriptors in Structure-Property Modeling and Virtual Screening -- The Scaffold Tree: An Efficient Navigation in the Scaffold Universe -- Pharmacophore-Based Virtual Screening -- De novo Drug Design -- Classification of Chemical Reactions and Chemoinformatics Approaches to Enzymatic Transformations -- Informatics Approach to the Rational Design of siRNA Libraries -- Beyond Rhodopsin: G Protein-Coupled Receptor Structure and Modeling Incorporating the β2-adrenergic and Adenosine A2A Crystal Structures -- Methods for Combinatorial and Parallel Library Design -- The Interweaving of Cheminformatics and HTS -- Computational Systems Chemical Biology -- Ligand-Based Approaches to In Silico Pharmacology -- Molecular Test Systems for Computational Selectivity Studies and Systematic Analysis of Compound Selectivity Profiles -- Application of Support Vector Machine-Based Ranking Strategies to Search for Target-Selective Compounds -- What Do We Know?: Simple Statistical Techniques that Help.
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| 650 |
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|a Bioinformatics.
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| 650 |
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0 |
|a Analytical chemistry.
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| 650 |
1 |
4 |
|a Bioinformatics.
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| 650 |
2 |
4 |
|a Analytical Chemistry.
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| 700 |
1 |
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|a Bajorath, Jürgen.
|e editor.
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| 710 |
2 |
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|a SpringerLink (Online service)
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| 773 |
0 |
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|t Springer eBooks
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