Computational Molecular Modelling In Structural Biology
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Computational Molecular Modelling In Structural Biology
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Author :
language : en
Publisher: Academic Press
Release Date : 2018-08-24
Computational Molecular Modelling In Structural Biology written by and has been published by Academic Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-08-24 with Science categories.
Computational Molecular modelling in Structural Biology, Volume 113, the latest release in the Advances in Protein Chemistry and Structural Biology, highlights new advances in the field, with this new volume presenting interesting chapters on charting the Bromodomain BRD4: Towards the Identification of Novel Inhibitors with Molecular Similarity and Receptor Mapping, and Computational Methods to Discover Compounds for the Treatment of Chagas Disease. Provides the authority and expertise of leading contributors from an international board of authors Presents the latest release in the Advances in Protein Chemistry and Structural Biology series Updated, with the latest information on Computational Molecular Modelling in Structural Biology
Computational Chemistry Methods In Structural Biology
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Author : Christo Christov
language : en
Publisher: Academic Press
Release Date : 2011-09-23
Computational Chemistry Methods In Structural Biology written by Christo Christov and has been published by Academic Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2011-09-23 with Science categories.
Published continuously since 1944, the Advances in Protein Chemistry and Structural Biology serial has been a continuous, essential resource for protein chemists. Covering reviews of methodology and research in all aspects of protein chemistry, including purification/expression, proteomics, modeling and structural determination and design, each volume brings forth new information about protocols and analysis of proteins while presenting the most recent findings from leading experts in a broad range of protein-related topics. This volume features articles on Computational Chemistry methods in Structural Biology. Essential resource for protein chemists This volume features articles on Computational Chemistry methods in Structural Biology
Computational Structural Biology
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Author : Manuel Claude Peitsch
language : en
Publisher: World Scientific
Release Date : 2008
Computational Structural Biology written by Manuel Claude Peitsch and has been published by World Scientific this book supported file pdf, txt, epub, kindle and other format this book has been release on 2008 with Science categories.
This work covers the impact of computational structural biology on protein structure prediction methods, macromolecular function and protein design, and key methods in drug discovery. It also addresses the computational challenges of experimental approaches in structural biology.
Computational Structural Biology
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Author :
language : en
Publisher:
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Computational Structural Biology written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on with categories.
Computational Biochemistry And Biophysics
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Author : Oren M. Becker
language : en
Publisher: CRC Press
Release Date : 2001-02-09
Computational Biochemistry And Biophysics written by Oren M. Becker and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2001-02-09 with Science categories.
Covering theoretical methods and computational techniques in biomolecular research, this book focuses on approaches for the treatment of macromolecules, including proteins, nucleic acids, and bilayer membranes. It uses concepts in free energy calculations, conformational analysis, reaction rates, and transition pathways to calculate and interpret biomolecular properties gleaned from computer-generated membrane simulations. It also demonstrates comparative protein structure modeling, outlines computer-aided drug design, discusses Bayesian statistics in molecular and structural biology, and examines the RISM-SCF/MCSCF approach to chemical processes in solution.
Molecular Modelling And Drug Design
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Author : Vintner
language : en
Publisher: CRC Press
Release Date : 1994-05-03
Molecular Modelling And Drug Design written by Vintner and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 1994-05-03 with Medical categories.
This book provides a myriad of fresh ideas and energetic approaches to the newer aspects of everyday drug modelling. With contributions from some of the best young talents of today, Molecular Modelling and Drug Design encourages a break from old traditions and probes the unexplored avenues of the modelling tool. The contributors' views act as a gauge to future trends in computer-aided drug design-an area that continues to expand and play an ever more significant role in drug discovery.
Computational Modelling In Structural Biology Insights From Small Angel Scattering And Molecular Dynamics Simulations
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Author :
language : en
Publisher:
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Computational Modelling In Structural Biology Insights From Small Angel Scattering And Molecular Dynamics Simulations written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on with categories.
Molecular Modeling Basics
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Author : Jan H. Jensen
language : en
Publisher: CRC Press
Release Date : 2010-04-26
Molecular Modeling Basics written by Jan H. Jensen and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2010-04-26 with Science categories.
Molecular modeling is becoming an increasingly important part of chemical research and education as computers become faster and programs become easier to use. The results, however, have not become easier to understand. Addressing the need for a "workshop-oriented" book, Molecular Modeling Basics provides the fundamental theory needed to understand
Lecture Notes On Computational Structural Biology
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Author : Zhijun Wu
language : en
Publisher: World Scientific
Release Date : 2008
Lecture Notes On Computational Structural Biology written by Zhijun Wu and has been published by World Scientific this book supported file pdf, txt, epub, kindle and other format this book has been release on 2008 with Science categories.
1. Introduction. 1.1. Protein structure. 1.2. Structure determination. 1.3. Dynamics simulation. 1.4. The myth of protein folding -- 2. X-ray crystallography computing. 2.1. The phase problem. 2.2. Least squares solutions. 2.3. Entropy maximization. 2.4. Indirect methods -- 3. NMR structure determination. 3.1. Nuclear magnetic resonance. 3.2. Distance geometry. 3.3. Distance-based modeling. 3.4. Structural analysis -- 4. Potential energy minimization. 4.1. Potential energy function. 4.2. Local optimization. 4.3. Global optimization. 4.4. Energy transformation -- 5. Molecular dynamics simulation. 5.1. Equations of motion. 5.2. Initial-value problem. 5.3. Boundary-value problem. 5.4. Normal mode analysis -- 6. Knowledge-based protein modeling. 6.1. Sequence/structural alignment. 6.2. Fold recognition/inverse folding. 6.3. Knowledge-based structural refinement. 6.4. Structural computing and beyond
Computational Modeling Of Biological Systems
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Author : Nikolay V Dokholyan
language : en
Publisher: Springer Science & Business Media
Release Date : 2012-02-12
Computational Modeling Of Biological Systems written by Nikolay V Dokholyan and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-02-12 with Science categories.
Computational modeling is emerging as a powerful new approach to study and manipulate biological systems. Multiple methods have been developed to model, visualize, and rationally alter systems at various length scales, starting from molecular modeling and design at atomic resolution to cellular pathways modeling and analysis. Higher time and length scale processes, such as molecular evolution, have also greatly benefited from new breeds of computational approaches. This book provides an overview of the established computational methods used for modeling biologically and medically relevant systems.