An essential guide to using Maxima, a popular open source symbolic mathematics engine to solve problems, build models, analyze data and explore fundamental conceptsSymbolic Mathematics for Chemists of
This book focuses on broadly defined areas of chemical information science-- with special emphasis on chemical informatics-- and computer-aided molecular design. The computational and cheminformatics
30 tutorials and more than 100 exercises in chemoinformatics, supported by online software and data sets Chemoinformatics is widely used in both academic and industrial chemical and biochemical resear
The strategy of this book is based upon the need to provide continuous reinforcement of safety throughout the chemistry curriculum – and throughout a career in the laboratory. To accomplish this goal,
Reporting on research at the University of Bayreuth into constructive combinatorics based on the use of finite groups actions, the book describes, extends, and applies methods of computer chemistry an
Distillation has historically been the main method for separating mixtures in the chemical process industry. However, despite the flexibility and widespread use of distillation processes, they still r
Reviews from previous editions:"Excel for Chemists should be part of any academic library offering courses and programs in Chemistry."—Choice"I highly recommend the book; treat yourself to it; assign
The second edition of this popular textbook has been revised to improve explanations and to add topics which were not featured in the first edition. It also contains extended, updated examples and ref
Chemists and other physical scientists and engineers, along with computer scientists and related researchers and practitioners describe the current status of cheminformatics, which uses computational
Support vector machines (SVMs) are used in a range of applications, including drug design, food quality control, metabolic fingerprint analysis, and microarray data-based cancer classification. While
This new edition of the Beran lab manual emphasizes chemical principles as well as techniques. The manual helps students understand the timing and situations for the various techniques. The Beran lab
"...this substantial and engaging text offers a wealth of practical (in every sense of the word) advice...Every undergraduate laboratory, and, ideally, every undergraduate chemist, should have a copy
Lodhi (computing, Imperial College London, UK) and Yamanishi (Kyoto University, Japan) compile 17 chapters of current research in machine learning and applications to chemoinformatics tasks to study
Unlike in the related area of bioinformatics, few books currently exist that document the techniques, tools, and algorithms of chemoinformatics. Bringing together worldwide experts in the field, the H
"Practical Aspects of Computational Chemistry" presents contributions on a range of aspects of Computational Chemistry applied to a variety of research fields.?The chapters focus on recent theoretical
An excellent resource for all graduate students and researchers using electrochemical techniques. After introducing the reader to the fundamentals, the book focuses on the latest developments in the t
The TACC conference deals with the theoretical methods and application of computational chemistry. The theoretical aspects include development of computational and statistical techniques, quantum and
A Practical Tool for Learning New MethodsQuality assurance and measurement uncertainty in analytical laboratories has become increasingly important. To meet increased scrutiny and keep up with new met
