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008			141020s2015 xxua o |||| 0|eng d
020			_a9781493914654
024	7		_a10.1007/978-1-4939-1465-4 _2doi
040			_aES-MaUEC _bspa _cES-MaUEC _dES-MaUEC
050		4	_aQP551 _b2015 EB
245	0	0	_aMolecular Modeling of Proteins _cedited by Andreas Kukol
250			_a2nd edition 2015
264		1	_aNew York, NY _bSpringer International Publishing _c2015
300			_a1 recurso en línea (X, 474 páginas) _b104 ilustraciones, 53 ilustraciones a color
336			_atexto _btxt _2rdacontent
337			_aelectrónico _bc _2rdamedia
338			_arecurso electrónico _bcr _2rdacarrier
347			_aarchivo de texto _bPDF
490	0		_aMethods in Molecular Biology _x1940-6029 _v1215
505	0		_aMolecular 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.
520			_aMolecular Modeling of Proteins, Second Edition provides a theoretical background of various methods available and enables non-specialists to apply methods to their problems by including updated chapters and new material not covered in the first edition. This detailed volume opens by featuring classical and advanced simulation methods as well as methods to set-up complex systems such as lipid membranes and membrane proteins, and continues with chapters devoted to the simulation and analysis of conformational changes of proteins, computational methods for protein structure prediction, usage of experimental data in combination with computational techniques, as well as protein-ligand interactions, which are relevant in the drug design process. Written for the highly successful Methods in Molecular Biology series, chapters include thorough introductions, step-by-step instructions, and notes on troubleshooting and avoiding common pitfalls. 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.
988			_aSpringer_Protocols_2015
650		7	_2embne _9669891 _aProteínas _xEstructura
776	0	8	_iPrinted edition: _z9781493914647
776	0	8	_iPrinted edition: _z9781493914661
776	0	8	_iPrinted edition: _z9781493954919
856	4	0	_uhttps://go.openathens.net/redirector/universidadeuropea.es?url=https://doi.org/10.1007/978-1-4939-1465-4 _zAcceso a este recurso digital (usuarios Universidad Europea de Madrid)
942			_2lcc _cLE
998			_b01/2024 _dz _eb _zSI