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The book builds on the analogy between social groups and assemblies of molecules to introduce the concepts of statistical mechanics, machine learning and data science. Applying a data analytics approach to molecular systems, we show how individual (molecular) features and interactions between molecules, or "communication" processes, allow for the prediction of properties and collective behavior of molecular systems - just as polling and social networking shed light on the behavior of social groups. Applications to systems at the cutting-edge of research for biological, environmental, and energy applications are also presented. Key features: Draws on a data analytics approach of molecular systems Covers hot topics such as artificial intelligence and machine learning of molecular trends Contains applications to systems at the cutting-edge of research for biological, environmental and energy applications Discusses molecular simulation and links with other important, emerging techniques and trends in computational sciences and society Authors have a well-established track record and reputation in the field
This monograph explores the participation of women in alchemy, chemical crafts, and the early stages of modern chemistry. By contextualizing their achievements within the broader social, cultural, and scientific landscapes of their time, this book enables readers to seize the challenges these women confronted and the obstacles they triumphed over. Alongside narrating how they shaped the development of chemistry, including their contributions to the body of chemical literature, it also emphasizes pivotal moments and milestones in the history of women's emancipation. The book's comprehensive and integrative approach, complemented by engaging storytelling, renders it an indispensable resource for students, researchers, and general readers alike.
Nanobiotechnology is a rapidly developing field of research with new applications constantly emerging. This book presents the basics, fundamental results and latest achievements of nanobiotechnological research. It extends as far as promising applications of new nanomaterials and newly discovered nanoeffects. Additionally, it presents a large variety of nanobio-analysis methods.
AI and Authorship in Scholarly Communication explores the role of artificial intelligence (AI) as it pertains to scholarly research and writing. Explaining what AI is and how it can be used by scholars, the book also focuses on aspects with the potential to change the scholarly communication landscape. Bringing together research on AI and writing from the scholarly literature in LIS and beyond, the book weaves together information about essential topics relating to AI and authorship. In laying out the primary concerns surrounding AI in the field of scholarly communication, Moulaison-Sandy considers how those concerns map to norms and practices in research and writing. The book likewise explo...
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This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Volume 27 covers brittle fracture, molecular detailed simulations of lipid bilayers, semiclassical bohmian dynamics, dissipative particle dynamics, trajectory-based rare event simulations, and understanding metal/metal electrical contact conductance from the atomic to continuum scales. Also included is a chapter on career opportunities in computational chemistry and an appendix listing the e-mail addresses of more than 2500 people in that discipline. FROM REVIEWS OF THE SERIES "Reviews in Computational Chemistry remains the most valuable reference to methods and techniques in computational chemistry." —JOURNAL OF MOLECULAR GRAPHICS AND MODELLING "One cannot generally do better than to try to find an appropriate article in the highly successful Reviews in Computational Chemistry. The basic philosophy of the editors seems to be to help the authors produce chapters that are complete, accurate, clear, and accessible to experimentalists (in particular) and other nonspecialists (in general)." —JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
The series Advances in Polymer Science presents critical reviews of the present and future trends in polymer and biopolymer science. It covers all areas of research in polymer and biopolymer science including chemistry, physical chemistry, physics, material science. The thematic volumes are addressed to scientists, whether at universities or in industry, who wish to keep abreast of the important advances in the covered topics. Advances in Polymer Science enjoys a longstanding tradition and good reputation in its community. Each volume is dedicated to a current topic, and each review critically surveys one aspect of that topic, to place it within the context of the volume. The volumes typical...