Molecular Modelling with Materials Studio® PDF Download
Are you looking for read ebook online? Search for your book and save it on your Kindle device, PC, phones or tablets. Download Molecular Modelling with Materials Studio® PDF full book. Access full book title Molecular Modelling with Materials Studio® by Ruth H. Howard. Download full books in PDF and EPUB format.
Author: Ruth H. Howard
Publisher: CRC Press
ISBN: 9781482249613
Category : Science
Languages : en
Pages : 400
Get Book Here
Book Description
Increasingly useful in materials research and development, molecular modelling is a method that combines computational chemistry techniques with graphics visualization for simulating and predicting the structure, chemical processes, and properties of materials. This book will help students and researchers alike in their application of modelling techniques and tools in the Materials Studio software suite adopted widely by academia and industry for their molecular modelling applications. It the last five years, over 10,000 scientific and peer-reviewed publications referenced the Materials Studio program.
Author: Ruth H. Howard
Publisher: CRC Press
ISBN: 9781482249613
Category : Science
Languages : en
Pages : 400
Get Book Here
Book Description
Increasingly useful in materials research and development, molecular modelling is a method that combines computational chemistry techniques with graphics visualization for simulating and predicting the structure, chemical processes, and properties of materials. This book will help students and researchers alike in their application of modelling techniques and tools in the Materials Studio software suite adopted widely by academia and industry for their molecular modelling applications. It the last five years, over 10,000 scientific and peer-reviewed publications referenced the Materials Studio program.
Author: Artur Wymyslowski
Publisher: Springer
ISBN: 3319128620
Category : Technology & Engineering
Languages : en
Pages : 203
Get Book Here
Book Description
This book offers readers a snapshot of the progression of molecular modeling in the electronics industry and how molecular modeling is currently being used to understand materials to solve relevant issues in this field. The reader is introduced to the evolving role of molecular modeling, especially seen from the perspective of the IEEE community and modeling in electronics. This book also covers the aspects of molecular modeling needed to understand the relationship between structures and mechanical performance of materials. The authors also discuss the transitional topic of multiscale modeling and recent developments on the atomistic scale and current attempts to reach the submicron scale, as well as the role that quantum mechanics can play in performance prediction.
Author: Alan Hinchliffe
Publisher: John Wiley & Sons
ISBN: 1119964814
Category : Science
Languages : en
Pages : 369
Get Book Here
Book Description
A concise, basic introduction to modelling and computational chemistry which focuses on the essentials, including MM, MC, and MD, along with a chapter devoted to QSAR and Discovery Chemistry. Includes supporting website featuring background information, full colour illustrations, questions and answers tied into the text,Visual Basic packages and many realistic examples with solutions Takes a hands-on approach, using state of the art software packages G03/W and/or Hyperchem, Gaussian .gjf files and sample outputs. Revised with changes in emphasis and presentation to appeal to the modern student.
Author: Phillip R. Westmoreland
Publisher: Springer Science & Business Media
ISBN: 9401707650
Category : Science
Languages : en
Pages : 596
Get Book Here
Book Description
Computational molecular and materials modeling has emerged to deliver solid technological impacts in the chemical, pharmaceutical, and materials industries. It is not the all-predictive science fiction that discouraged early adopters in the 1980s. Rather, it is proving a valuable aid to designing and developing new products and processes. People create, not computers, and these tools give them qualitative relations and quantitative properties that they need to make creative decisions. With detailed analysis and examples from around the world, Applying Molecular and Materials Modeling describes the science, applications, and infrastructures that have proven successful. Computational quantum chemistry, molecular simulations, informatics, desktop graphics, and high-performance computing all play important roles. At the same time, the best technology requires the right practitioners, the right organizational structures, and - most of all - a clearly understood blend of imagination and realism that propels technological advances. This book is itself a powerful tool to help scientists, engineers, and managers understand and take advantage of these advances.
Author: W. Andrzej Sokalski
Publisher: Springer Science & Business Media
ISBN: 140205372X
Category : Science
Languages : en
Pages : 597
Get Book Here
Book Description
Design of new molecular materials is emerging as a new interdisciplinary research field. Corresponding reports are scattered in literature, and this book constitutes one of the first attempts to overview ongoing research efforts. It provides basic information, as well as the details of theory and examples of its application, to experimentalists and theoreticians interested in modeling molecular properties and putting into practice rational design of new materials.
Author: Tamar Schlick
Publisher: Springer Science & Business Media
ISBN: 0387224645
Category : Science
Languages : en
Pages : 669
Get Book Here
Book Description
Very broad overview of the field intended for an interdisciplinary audience; Lively discussion of current challenges written in a colloquial style; Author is a rising star in this discipline; Suitably accessible for beginners and suitably rigorous for experts; Features extensive four-color illustrations; Appendices featuring homework assignments and reading lists complement the material in the main text
Author: Artur Wymyslowski
Publisher:
ISBN: 9783319110882
Category : Technology & Engineering
Languages : en
Pages : 290
Get Book Here
Book Description
Author: Marco Antonio Chaer Nascimento
Publisher: World Scientific
ISBN: 9814552119
Category :
Languages : en
Pages : 174
Get Book Here
Book Description
This volume attempts to show molecular modeling as a new multidisciplinary area of research that transcends the boundaries traditionally separating biology, chemistry and physics. To this purpose, leading scientists present applications of molecular modeling to a variety of important problems such as: drug design, protein modeling, catalyst modeling, properties of glass, mechanical properties of materials and materials design. The emphasis here is on the atomistic approach.
Author: Hans-Dieter Höltje
Publisher: John Wiley & Sons
ISBN: 3527614761
Category : Science
Languages : en
Pages : 206
Get Book Here
Book Description
Written by experienced experts in molecular modeling, this books describes the basics to the extent that is necessary if one wants to be able to reliably judge the results from molecular modeling calculations. Its main objective is the description of the various pitfalls to be avoided. Without unnecessary overhead it leads the reader from simple calculations on small molecules to the modeling of proteins and other relevant biomolecules. A textbook for beginners as well as an invaluable reference for all those dealing with molecular modeling in their daily work!
Author: Alan Hinchliffe
Publisher: Wiley
ISBN: 9780471489931
Category : Science
Languages : en
Pages : 0
Get Book Here
Book Description
The application of mathematical models to molecules has now reached maturity. Scientists as diverse as astrophysicists, biologists, chemists, materials scientists and zoologists can reach for their PC, Mac or laptop to model molecular phenomena of unbelievable complexity. Following the highly successful first edition of Modelling Molecular Structures, this newly updated edition is your guide through the myriad of applications for molecular modelling. This easy-to-read, highly illustrated text covers all areas of molecular modelling, including molecular dynamics, quantum mechanics, and the Hartree-Fock self-consistent field model, providing background information and critically discussing the latest techniques in the field. Covering developments in the field since the first publication, this title also includes updated text and new material on: * Molecular Dynamics * Dealing with the Solvent This title is an indispensable introduction for all chemists, materials scientists, molecular biologists, and researchers working in, and interested in, the field of molecular modelling.
