Frontiers in Computational Chemistry: Volume 2

Computer Applications for Drug Design and Biomolecular Systems

Nonfiction, Science & Nature, Science, Chemistry, Analytic
Cover of the book Frontiers in Computational Chemistry: Volume 2 by Zaheer Ul-Haq, Jeffry D. Madura, Elsevier Science
View on Amazon View on AbeBooks View on Kobo View on B.Depository View on eBay View on Walmart
Author: Zaheer Ul-Haq, Jeffry D. Madura ISBN: 9781608059782
Publisher: Elsevier Science Publication: December 16, 2015
Imprint: Bentham Science Publishers Language: English
Author: Zaheer Ul-Haq, Jeffry D. Madura
ISBN: 9781608059782
Publisher: Elsevier Science
Publication: December 16, 2015
Imprint: Bentham Science Publishers
Language: English

Frontiers in Computational Chemistry, originally published by Bentham and now distributed by Elsevier, presents the latest research findings and methods in the diverse field of computational chemistry, focusing on molecular modeling techniques used in drug discovery and the drug development process. This includes computer-aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity. In Volume 2, the authors continue the compendium with nine additional perspectives in the application of computational methods towards drug design. This volume covers an array of subjects from modern hardware advances that accelerate new antibacterial peptide identification, electronic structure methods that explain how singlet oxygen damages DNA, to QSAR model validation, the application of DFT and DFRT methods on understanding the action of nitrogen mustards, the design of novel prodrugs using molecular mechanics and molecular orbital methods, computational simulations of lipid bilayers, high throughput screening methods, and more.

  • Brings together a wide range of research into a single collection to help researchers keep up with new methods
  • Uniquely focuses on computational chemistry approaches that can accelerate drug design
  • Makes a solid connection between experiment and computation, and the novel application of computational methods in the fields of biology, chemistry, biochemistry, physics, and biophysics
View on Amazon View on AbeBooks View on Kobo View on B.Depository View on eBay View on Walmart

Frontiers in Computational Chemistry, originally published by Bentham and now distributed by Elsevier, presents the latest research findings and methods in the diverse field of computational chemistry, focusing on molecular modeling techniques used in drug discovery and the drug development process. This includes computer-aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity. In Volume 2, the authors continue the compendium with nine additional perspectives in the application of computational methods towards drug design. This volume covers an array of subjects from modern hardware advances that accelerate new antibacterial peptide identification, electronic structure methods that explain how singlet oxygen damages DNA, to QSAR model validation, the application of DFT and DFRT methods on understanding the action of nitrogen mustards, the design of novel prodrugs using molecular mechanics and molecular orbital methods, computational simulations of lipid bilayers, high throughput screening methods, and more.

More books from Elsevier Science

Cover of the book Biscuit Baking Technology by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Multivariate Analysis of Data in Sensory Science by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Microchannel Phase Change Transport Phenomena by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Polypropylene by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Information Literacy by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Proteome Characterization and Proteomics by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Ostracoda as Proxies for Quaternary Climate Change by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Handbook of Magnetic Materials by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Advances in Asphalt Materials by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book From Gene to Protein: Information Transfer in Normal and Abnormal Cells by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Multivariate Polysplines by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Casing and Liners for Drilling and Completion by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Vectors in Two or Three Dimensions by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Analog Circuit Design Volume 2 by Zaheer Ul-Haq, Jeffry D. Madura
Cover of the book Random Matrices by Zaheer Ul-Haq, Jeffry D. Madura
We use our own "cookies" and third party cookies to improve services and to see statistical information. By using this website, you agree to our Privacy Policy