Christian Hill
Python for Chemists
Python for Chemists
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This guide provides a comprehensive introduction to Python for students and researchers in chemistry, focusing on applications in chemical physics. It covers basic syntax, data structures, and popular numerical packages, with end-of-chapter problems and additional resources on a companion website.
Format: Paperback / softback
Length: 572 pages
Publication date: 26 October 2023
Publisher: Cambridge University Press
This comprehensive and self-contained guide offers an in-depth introduction to the widely used programming language Python, with a particular emphasis on its applications in chemistry and chemical physics. Designed to cater to students and researchers in the field of chemistry who are seeking to leverage Python for problem-solving in their research endeavors, this fast-paced primer begins by establishing a solid foundation in the programming language. It then progresses to cover advanced concepts and practical applications in chemistry, enabling readers to effectively utilize Python for computational problem-solving.
The required syntax and data structures are introduced, providing a solid foundation for readers to build upon. These foundational elements are applied to solve problems computationally, fostering a deep understanding of the language's capabilities.
Popular numerical packages, such as NumPy, SciPy, Matplotlib, SymPy, and pandas, are described in detail, offering readers a comprehensive understanding of their functionalities and how they can be utilized to enhance chemical research. End-of-chapter problems are included throughout the book, accompanied by worked solutions, allowing readers to practice and reinforce their understanding of the topics covered.
Furthermore, a companion website is provided, offering additional resources, datasets, and Jupyter Notebooks. These resources enable readers to further enhance their knowledge and gain confidence in applying their Python skills through hands-on approaches. Whether you are a novice Python programmer or a seasoned researcher looking to expand your programming skills in chemistry, this guide is an invaluable resource for your journey.
ISBN-13: 9781009102049
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