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| Link zu diesem Datensatz | https://d-nb.info/1385568119 |
| Titel | Artificial Intelligence for Drug Design / edited by Honglin Li, Mingyue Zheng, Feng Zhu, Fang Bai |
| Person(en) |
Li, Honglin (Herausgeber) Zheng, Mingyue (Herausgeber) Zhu, Feng (Herausgeber) Bai, Fang (Herausgeber) |
| Organisation(en) | SpringerLink (Online service) (Sonstige) |
| Ausgabe | 1st ed. 2026 |
| Verlag | Singapore : Springer Nature Singapore, Imprint: Springer |
| Zeitliche Einordnung | Erscheinungsdatum: 2026 |
| Umfang/Format | Online-Ressource, 247 illus., 215 illus. in color. eReference. : online resource. |
| Andere Ausgabe(n) | Printed edition:: ISBN: 978-981-95-2524-9 |
| Inhalt | Part 1 Foundations of Machine Learning -- Chapter 1 Supervised Learning -- Chapter 2 Unsupervised Learning -- Chapter 3 Reinforcement Learning -- Chapter 4 Model Evaluation and Validation -- Chapter 5 Application Examples and Code -- Part 2 Fundamentals of Deep Network Architecture Design -- Chapter 6 Convolutional Neural Networks -- Chapter 7 Recurrent Neural Networks -- Chapter 8 Transformer -- Chapter 9 Graph Neural Networks -- Part 3 Deep Generative Models -- Chapter 10 Variational Self-Encoders -- Chapter 11 Generative Adversarial Networks 084 -- Chapter 12 Stream Generative Models 088 -- Part 4 Deep Reinforcement Learning -- Chapter 13 Value Function-Based Algorithms -- Chapter 14 Policy Gradient Algorithms -- Chapter 15 CartPole Programming Examples -- Part 5 Natural Language Processing, Knowledge Graphs, and Interpretable Artificial Intelligence -- Chapter 16 Natural Language Processing and Text Mining -- Chapter 17 Knowledge Mapping -- Chapter 18 Interpretable Artificial Intelligence -- Part 6 Molecular Structure and Bioactivity Data -- Chapter 19 Biomolecule Structure Database -- Chapter 20 Small Molecule Structure Databases -- Chapter 21 Bioactive Databases -- Part 7 Molecular Data Representation -- Chapter 22 Characterization of Small Molecule Compounds -- Chapter 23 Protein Characterization -- Chapter 24 Characterization of Nucleic Acid Sequences -- Part 8 Drug Target Discovery and Identification -- Chapter 25 Biomics Analysis and Drug Target Discovery and Drug Repositioning -- Chapter 26 Sequence-Based Discovery of Druggable Targets of Proteins -- Chapter 27 Structure- and Network-Based Drugable Target Identification -- Chapter 28 Network Pharmacology and Drug Redirection -- Part 9 Molecular Structure Prediction -- Chapter 29 Protein Structure Prediction -- Chapter 30 Nucleic Acid Structure Prediction -- Chapter 31 Conformational Prediction of Small Molecules -- Part 10 The Developments in Quantum Chemistry and Molecular Force Fields -- Chapter 32 Artificial Intelligence for Computational Chemistry -- Chapter 33 Development and Optimization of Molecular Force Fields -- Part 11 Small Molecule Drug Synthesis and De Novo Design -- Chapter 34 Fragment-Based Drug Design -- Chapter 35 Molecular Generative Modeling -- Chapter 36 Three-Dimensional Molecular Generation -- Chapter 37 Inverse Synthesis Prediction -- Chapter 38 Reaction Performance Prediction and Reaction Condition Optimization -- Part 12 Small Molecule Drug Design and Optimization -- Chapter 39 Small Molecule-Target Binding Affinity Prediction and Scoring Function Design -- Chapter 40 Molecular Docking and Virtual Screening Methods Incorporating Artificial Intelligence -- Chapter 41 Ligand-Based Virtual Screening -- Part 13 AI-Based Design of Macromolecular Drugs -- Chapter 42 Macrocyclic Drug Design -- Chapter 43 Protein and Peptide Macromolecular Drug Design -- Chapter 44 Nucleic Acid Macromolecular Drug Design -- Part 14 ADMET Property Prediction -- Chapter 45 Artificial Intelligence-Based ADMET Prediction -- Chapter 46 Drug Toxicity Prediction -- Chapter 47 Drug Metabolite Prediction -- Part 15 Drug Crystal Form Prediction and Formulation Design -- Chapter 48 Drug Crystal Form Prediction -- Chapter 49 Drug Dosage Form Design |
| Persistent Identifier |
URN: urn:nbn:de:101:1-2601010307097.765914907433 DOI: 10.1007/978-981-95-2525-6 |
| URL | https://doi.org/10.1007/978-981-95-2525-6 |
| ISBN/Einband/Preis | 978-981-95-2525-6 |
| Sprache(n) | Englisch (eng) |
| Sachgruppe(n) | 610 Medizin, Gesundheit |
| Online-Zugriff | Archivobjekt öffnen |
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