Molecular Modeling of Proteins
Humana Press Inc. (Verlag)
978-1-4939-1464-7 (ISBN)
Update-to-date and authoritative, Molecular Modeling of Proteins, Second Edition aims to aid researchers in the physical, chemical and biosciences interested in utilizing this powerful technology.
Molecular Dynamics Simulations.- Transition Path Sampling with Quantum/Classical Mechanics for Reaction Rates.- Current Status of Protein Force Fields for Molecular Dynamics Simulations.- Lipid Membranes for Membrane Proteins.- Molecular Dynamics Simulations of Membrane Proteins.- Membrane-Associated Proteins and Peptides.- Coarse-Grained Force Fields for Molecular Simulations.- Tackling Sampling Challenges in Biomolecular Simulations.- Calculation of Binding Free Energies.- The Use of Experimental Structures to Model Protein Dynamics.- Computing Ensembles of Transitions with Molecular Dynamics Simulations.- Accelerated Molecular Dynamics and Protein Conformational Change: A Theoretical and Practical Guide Using a Membrane Embedded Model Neurotransmitter Transporter.- Simulations and Experiments in Protein Folding.- Comparative Modeling of Proteins.- De Novo Membrane Protein Structure Prediction.- NMR-Based Modeling and Refinement of Protein 3D Structures.- Methods for Predicting Protein Ligand Binding Sites.- Information-Driven Structural Modelling of Protein-Protein Interactions.- Identifying Putative Drug Targets and Potential Drug Leads: Starting Points for Virtual Screening and Docking.- Molecular Docking to Flexible Targets.
Reihe/Serie | Methods in Molecular Biology ; 1215 |
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Zusatzinfo | 53 Illustrations, color; 51 Illustrations, black and white; X, 474 p. 104 illus., 53 illus. in color. With online files/update. |
Verlagsort | Totowa, NJ |
Sprache | englisch |
Maße | 178 x 254 mm |
Themenwelt | Informatik ► Weitere Themen ► Bioinformatik |
Naturwissenschaften ► Biologie ► Biochemie | |
Naturwissenschaften ► Biologie ► Mikrobiologie / Immunologie | |
Schlagworte | Biomolecule simulation • computational methods • Membrane Proteins • Molecular Modeling • Protein Structure Prediction • simulation methods |
ISBN-10 | 1-4939-1464-2 / 1493914642 |
ISBN-13 | 978-1-4939-1464-7 / 9781493914647 |
Zustand | Neuware |
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