{"product_id":"cheminformatic-modeling-and-data-gap-kunal-roy-9780443364747","title":"Cheminformatic Modeling and Data Gap Filling for a Green and Sustainable Environment","description":"\u003ci\u003eCheminformatic Modelling and Data Gap Filling for a Green and Sustainable Environment \u003c\/i\u003ecovers the theory and practices of chemical informatics, focusing on modeling various properties and endpoints related to chemicals for improved chemical management and the design of safer chemicals to promote environmental sustainability. Across four sections, the book outlines modeling techniques such as quantitative structure-property relationship (QSPR), read-across, and machine learning for modeling environmental endpoints of chemicals. OECD guidelines are discussed and considered for model development and validation, documentation using the QSAR modeling reporting format (QMRF), and regulatory requirements for result presentation. \u003cp\u003e\u003c\/p\u003eThe book offers full datasets, algorithm information, and real-world case studies for all models, along with worked examples. It will serve as an essential resource for chemists and environmental scientists working in green and sustainable chemistry, but will be a great resource for students and academics at graduate level and above studying cheminformatics. This book will also be of interest to researchers developing new and sustainable chemicals and for decision-makers looking to make industrial processes more sustainable.\u003cbr\u003e\u003cbr\u003e\u003cb\u003eAuthor:\u003c\/b\u003e Kunal Roy\u003cbr\u003e\u003cb\u003eISBN-10:\u003c\/b\u003e 0443364745\u003cbr\u003e\u003cb\u003eISBN-13:\u003c\/b\u003e 9780443364747\u003cbr\u003e\u003cb\u003ePublisher:\u003c\/b\u003e Elsevier\u003cbr\u003e\u003cb\u003eLanguage:\u003c\/b\u003e English\u003cbr\u003e\u003cb\u003ePublished:\u003c\/b\u003e 05\/15\/2026\u003cbr\u003e\u003cb\u003ePages:\u003c\/b\u003e 350\u003cbr\u003e\u003cb\u003eFormat:\u003c\/b\u003e Paperback\u003cbr\u003e\u003cb\u003eWeight:\u003c\/b\u003e 0.99lbs","brand":"Kunal Roy","offers":[{"title":"Paperback","offer_id":48520129675519,"sku":"9780443364747","price":200.0,"currency_code":"USD","in_stock":false}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0662\/2982\/9887\/files\/img_22334195-a85f-408d-a098-29eb52c3ce8c.jpg?v=1778740921","url":"https:\/\/www.whiterainbookhouse.com\/products\/cheminformatic-modeling-and-data-gap-kunal-roy-9780443364747","provider":"WR Book House","version":"1.0","type":"link"}