Kategoria BISAC: Science >> Chemistry - Computational & Molecular Modeling

Examines the intersection of quantum information and chemical physics

The Advances in Chemical Physics series is dedicated to reviewing new and emerging topics as well as the latest developments in traditional areas of study in the field of chemical physics. Each volume features detailed comprehensive analyses coupled with individual points of view that integrate the many disciplines of science that are needed for a full understanding of chemical physics.

This volume of the series explores the latest research findings, applications, and new research paths from the...

The cutting edge of research in chemical physics

Each volume of the Advances in Chemical Physics series discusses aspects of the state of diverse subjects in chemical physics and related fields, with chapters written by top researchers in the field. Reviews published in Advances in Chemical Physics are typically longer than those published in journals, providing the space needed for readers to fully grasp the topic, including fundamentals, latest discoveries, applications, and emerging avenues of research.

Volume 155 explores:

• Modeling viral capsid...

Illustrates the application of mathematical and computational modeling in a variety of disciplines

With an emphasis on the interdisciplinary nature of mathematical and computational modeling, Mathematical and Computational Modeling: With Applications in the Natural and Social Sciences, Engineering, and the Arts features chapters written by well-known, international experts in these fields and presents readers with a host of state-of-the-art achievements in the development of mathematical modeling and computational experiment methodology. The book is a valuable guide...

Advances in Chemical Physics is the only series of volumes available that explores the cutting edge of research in chemical physics.

• This is the only series of volumes available that presents the cutting edge of research in chemical physics.
• Includes contributions from experts in this field of research.
• Contains a representative cross-section of research that questions established thinking on chemical solutions.
• Structured with an editorial framework that makes the book an excellent supplement to an advanced...

This book presents an authoritative and in-depth treatment of potential energy landscape theory, a powerful analytical approach to describing the atomic and molecular interactions in condensed-matter phenomena. Drawing on the latest developments in the computational modeling of many-body systems, Frank Stillinger applies this approach to a diverse range of substances and systems, including crystals, liquids, glasses and other amorphous solids, polymers, and solvent-suspended biomolecules.

Stillinger focuses on the topography of the multidimensional potential energy hypersurface...

Anwendungsgebiete und Programmiermoglichkeiten von Excel 2013 werden praxisorientiert im Buch vorgestellt. Der Einsatz von Excel und VBA wird anhand von Beispielen aus verschiedenen Zweigen der Naturwissenschaften, der Mathematik und der Informatik erlautert. Weit uber 100 Anwendungen inklusive benutzter Algorithmen und Aufbau des jeweiligen Excel-Arbeitsblattes werden dargestellt. Zusatzmaterial steht online bereit. Das Buch bietet damit eine umfangreiche Einfuhrung in die Software.

• Thermodynamic Perturbation Theory for Associating Molecules
• Path Integrals and Effective Potentials in the Study of Monatomic Fluids at Equilibrium
• Sponteneous Symmetry Breaking in Matter Induced by Degeneracies and Pseudogeneracies
• Mean-Field Electrostatics Beyond the Point-Charge Description
• First Passage Processes in Cellular...

Advances in Mathematical Chemistry and Applications highlights the recent progress in the emerging discipline of discrete mathematical chemistry. Editors Subhash C. Basak, Guillermo Restrepo, and Jose Luis Villaveces have brought together 27 chapters written by 68 internationally renowned experts in these two volumes.

Each volume comprises a wise integration of mathematical and chemical concepts and covers numerous applications in the field of drug discovery, bioinformatics, chemoinformatics, computational biology, mathematical proteomics, and ecotoxicology.

Volume...