Are you looking for read ebook online? Search for your book and save it on your Kindle device, PC, phones or tablets. Download Mathematical Aspects Of Chemical And Biochemical Problems And Quantum Chemistry PDF full book. Access full book title Mathematical Aspects Of Chemical And Biochemical Problems And Quantum Chemistry.
| Author | : Donald S. Cohen |
| Publisher | : American Mathematical Soc. |
| Total Pages | : 244 |
| Release | : 1974 |
| Genre | : Mathematics |
| ISBN | : 9780821813287 |
| Author | : Society for Industrial and Applied Mathematics |
| Publisher | : |
| Total Pages | : 153 |
| Release | : 1974 |
| Genre | : |
| ISBN | : |
| Author | : Donald S. Cohen |
| Publisher | : |
| Total Pages | : 153 |
| Release | : 1974 |
| Genre | : |
| ISBN | : |
| Author | : Donald S. Cohen |
| Publisher | : |
| Total Pages | : |
| Release | : 1974 |
| Genre | : |
| ISBN | : |
| Author | : Committee on Mathematical Challenges from Computational Chemistry |
| Publisher | : National Academies Press |
| Total Pages | : 144 |
| Release | : 1995-04-12 |
| Genre | : Mathematics |
| ISBN | : 0309560640 |
Computational methods are rapidly becoming major tools of theoretical, pharmaceutical, materials, and biological chemists. Accordingly, the mathematical models and numerical analysis that underlie these methods have an increasingly important and direct role to play in the progress of many areas of chemistry. This book explores the research interface between computational chemistry and the mathematical sciences. In language that is aimed at non-specialists, it documents some prominent examples of past successful cross-fertilizations between the fields and explores the mathematical research opportunities in a broad cross-section of chemical research frontiers. It also discusses cultural differences between the two fields and makes recommendations for overcoming those differences and generally promoting this interdisciplinary work.
| Author | : S. M. Blinder |
| Publisher | : Elsevier |
| Total Pages | : 423 |
| Release | : 2018-11-26 |
| Genre | : Science |
| ISBN | : 0128137010 |
Mathematical Physics in Theoretical Chemistry deals with important topics in theoretical and computational chemistry. Topics covered include density functional theory, computational methods in biological chemistry, and Hartree-Fock methods. As the second volume in the Developments in Physical & Theoretical Chemistry series, this volume further highlights the major advances and developments in research, also serving as a basis for advanced study. With a multidisciplinary and encompassing structure guided by a highly experienced editor, the series is designed to enable researchers in both academia and industry stay abreast of developments in physical and theoretical chemistry. Brings together the most important aspects and recent advances in theoretical and computational chemistry Covers computational methods for small molecules, density-functional methods, and computational chemistry on personal and quantum computers Presents cutting-edge developments in theoretical and computational chemistry that are applicable to graduate students and research professionals in chemistry, physics, materials science and biochemistry
| Author | : Jay Martin Anderson |
| Publisher | : Courier Corporation |
| Total Pages | : 177 |
| Release | : 2012-12-13 |
| Genre | : Science |
| ISBN | : 0486151484 |
Introduction to problems of molecular structure and motion covers calculus of orthogonal functions, algebra of vector spaces, and Lagrangian and Hamiltonian formulation of classical mechanics. Answers to problems. 1966 edition.
| Author | : Gyorgy Pota |
| Publisher | : Elsevier |
| Total Pages | : 258 |
| Release | : 2011-08-30 |
| Genre | : Mathematics |
| ISBN | : 0080464890 |
Mathematical Problems for Chemistry Students has been compiled and written (a) to help chemistry students in their mathematical studies by providing them with mathematical problems really occurring in chemistry (b) to help practising chemists to activate their applied mathematical skills and (c) to introduce students and specialists of the chemistry-related fields (physicists, mathematicians, biologists, etc.) into the world of the chemical applications. Some problems of the collection are mathematical reformulations of those in the standard textbooks of chemistry, others were taken from theoretical chemistry journals. All major fields of chemistry are covered, and each problem is given a solution. This problem collection is intended for beginners and users at an intermediate level. It can be used as a companion to virtually all textbooks dealing with scientific and engineering mathematics or specifically mathematics for chemists. * Covers a wide range of applications of the most essential tools in applied mathematics * A new approach to a number of classical textbook-problems * A number of non-classical problems are included
| Author | : Subhash C. Basak |
| Publisher | : Elsevier |
| Total Pages | : 356 |
| Release | : 2016-02-11 |
| Genre | : Mathematics |
| ISBN | : 1681080524 |
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 2 explores deeper the topics introduced in Volume 1, with numerous additional topics such as topological approaches for classifying fullerene isomers; chemical reaction networks; discrimination of small molecules using topological molecular descriptors; GRANCH methods for the mathematical characterization of DNA, RNA and protein sequences; linear regression methods and Bayesian techniques; in silico toxicity prediction methods; drug design; integration of bioinformatics and systems biology, molecular docking, and molecular dynamics; metalloenzyme models; protein folding models; molecular periodicity; generalized topologies and their applications; and many more. Brings together both the theoretical and practical aspects of the fundamental concepts of mathematical chemistry Covers applications in diverse areas of physics, chemistry, drug discovery, predictive toxicology, systems biology, chemoinformatics, and bioinformatics About half of the book focuses primarily on current work, new applications, and emerging approaches for the mathematical characterization of essential aspects of molecular structure, while the other half describes applications of structural approach to new drug discovery, virtual screening, protein folding, predictive toxicology, DNA structure, and systems biology
| Author | : Subhash C. Basak |
| Publisher | : Elsevier |
| Total Pages | : 378 |
| Release | : 2016-02-11 |
| Genre | : Science |
| ISBN | : 1681081970 |
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 1 includes chapters on mathematical structural descriptors of molecules and biomolecules, applications of partially ordered sets (posets) in chemistry, optimal characterization of molecular complexity using graph theory, different connectivity matrices and their polynomials, use of 2D fingerprints in similarity-based virtual screening, mathematical approaches to molecular structure generation, comparability graphs, applications of molecular topology in drug design, density functional theory of chemical reactivity, application of mathematical descriptors in the quantification of drug-likeness, utility of pharmacophores in drug design, and much more. Brings together both the theoretical and practical aspects of the fundamental concepts of mathematical chemistry Covers applications in diverse areas of physics, chemistry, drug discovery, predictive toxicology, systems biology, chemoinformatics, and bioinformatics Revised 2015 edition includes a new chapter on the current landscape of hierarchical QSAR modelling About half of the book focuses primarily on current work, new applications, and emerging approaches for the mathematical characterization of essential aspects of molecular structure, while the other half describes applications of structural approach to new drug discovery, virtual screening, protein folding, predictive toxicology, DNA structure, and systems biology
