{"product_id":"handbook-of-chemoinformatics-algorithms","title":"Handbook of Chemoinformatics Algorithms","description":"\u003cp\u003eUnlike 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 \u003cstrong\u003eHandbook of Chemoinformatics Algorithms\u003c\/strong\u003e provides an overview of the most common chemoinformatics algorithms in a single source.\u003c\/p\u003e\u003cp\u003eAfter a historical perspective of the applications of algorithms and graph theory to chemical problems, the book presents algorithms for two-dimensional chemical structures and three-dimensional representations of molecules. It then focuses on molecular descriptors, virtual screening methods, and quantitative structure–activity relationship (QSAR) models, before introducing algorithms to enumerate and sample chemical structures. The book also covers computer-aided molecular design, reaction network generation, and open source software and database technologies. The remaining chapters describe techniques developed in the context of bioinformatics and computational biology and their potential applications to chemical problems.\u003c\/p\u003e\u003cp\u003eThis handbook presents a selection of algorithms relevant in practice, making the book useful to those working in the field. It offers an up-to-date account of many algorithmic aspects of chemoinformatics.\u003c\/p\u003e","brand":"Taylor \u0026 Francis Ltd","offers":[{"title":"Default Title","offer_id":54224678125912,"sku":"9781420082920","price":210.8,"currency_code":"EUR","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0278\/1295\/4195\/files\/9781420082920.jpg?v=1777035659","url":"https:\/\/agendabookshop.com\/products\/handbook-of-chemoinformatics-algorithms","provider":"Agenda Bookshop","version":"1.0","type":"link"}