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|a Young, David C.,
|d 1964-
|9 394569
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| 245 |
1 |
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|a Computational drug design :
|b a guide for computational and medicinal chemists
|c / David C. Young.
|
| 260 |
|
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|a Hoboken, N.J. :
|b John Wiley & Sons,
|c c2009.
|
| 300 |
|
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|a xxxvi, 307 páginas. :
|b ilustraciones ;
|c 25 cm +
|e 1 disco compacto (4 3/4 plg.).
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| 504 |
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|a Incluye bibliografías e índice.
|
| 505 |
0 |
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|a Introduction -- Properties that make a molecule a good drug -- Target identification -- Target characterization -- The drug design process for a known protein target -- The drug design process for an unknown target -- Drug design for other targets -- Compound library design -- Computational tools and techniques -- Homology model building -- Molecular mechanics -- Protein folding -- Docking -- Pharmacophore models -- QSAR -- 3D-QSAR -- Quantum mechanics in drug design -- De Novo and other AI techniques -- Cheminformatics -- ADMET -- Multiobjective optimization -- Automation of tasks -- Bioinformatics -- Simulations at the cellular and organ level -- Synthesis route prediction -- Proteomics -- Prodrug approaches -- Future developments in drug design.
|
| 650 |
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7 |
|a Drogas
|x Diseño
|x Modelos matemáticos.
|9 3141
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| 650 |
|
7 |
|a Drogas
|x Diseño
|x Procesamiento de datos.
|9 3141
|
| 856 |
4 |
1 |
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