{"product_id":"molecular-modeling-basics-paperback-softback","title":"Molecular Modeling Basics - Paperback \/ softback","description":"\u003cp\u003eMolecular modeling is becoming an increasingly important part of chemical research and education as computers become faster and programs become easier to use. The results, however, have not become easier to understand. Addressing the need for a \"workshop-oriented\" book, \u003cstrong\u003eMolecular Modeling Basics\u003c\/strong\u003e provides the fundamental theory needed to understand not only what molecular modeling programs do, but also the gist of research papers that describe molecular modeling results.\u003c\/p\u003e\u003cp\u003e Written in a succinct manner using informal language, the book presents concise coverage of key concepts suitable for novices to the field. It begins by examining the potential energy surface (PES), which provides the connection between experimental data and molecular modeling. It explores ways to calculate energy by molecular and quantum mechanics. It describes molecular properties and the condensed phase, and shows how to extract and interpret information from a program output. The author uses hands-on exercises to illustrate concepts and he supplements the text with a \u003ca href=\"http:\/\/www.molecularmodelingbasics.blogspot.com\/\"\u003eblog containing animated tutorials and interactive figures\u003c\/a\u003e.\u003c\/p\u003e\u003cp\u003e Drawn from the author’s own lecture notes from a class he taught for many years at the University of Iowa, this volume introduces topics in such a way that beginners can clearly comprehend molecular modeling results. A perfect supplement to a molecular modeling textbook, the book offers students the \"hands-on\" practice they need to grasp sophisticated concepts.\u003c\/p\u003e\u003cp\u003e In addition to his blog, the author maintains a website describing his \u003ca href=\"http:\/\/propka.ki.ku.dk\/~luca\/wiki\/index.php\/JansPage\"\u003eresearch\u003c\/a\u003e and one detailing his \u003ca href=\"http:\/\/proteinsandwavefunctions.blogspot.com\/\"\u003eseminars\u003c\/a\u003e.\u003c\/p\u003e","brand":"Taylor \u0026 Francis","offers":[{"title":"Default Title","offer_id":45576267792622,"sku":"9781420075267","price":92.8,"currency_code":"AUD","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0630\/9612\/7726\/files\/9781420075267.jpg?v=1720968943","url":"https:\/\/bookland.com.au\/products\/molecular-modeling-basics-paperback-softback","provider":"Book Land AU","version":"1.0","type":"link"}