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Introduction to Computational Chemistry 3rd Edition provides a comprehensive account of the fundamental principles underlying different;
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Observing computational chemistry's proven value to the introduction of new medicines, this reference offers the techniques most frequently;
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should come away with the ability to apply and adapt these techniques in computational chemistry to his or her own research problems, and have an;
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chemistry being described. Computational Chemistry provides a user-friendly introduction to this powerful way of characterizing and modelling;
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Front Matter Executive Summary Introduction The Emergence of Computational Chemistry Examples of Constructive Cross-Fertilization Between;
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-based approaches and explores their use in computational chemistry. Beginning with an introduction to DMRG and DMRG-based approaches, the book;
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The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert;
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popular spreadsheet and computational software to solve problems in physical chemistry. The book provides students with a complementary approach;
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foundational information on AI in chemistry, with an introduction to the field and guidance on database usage and statistical analysis to help support;
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in computational chemistry as applied to all chemical disciplines. Topics covered include quantum chemistry, molecular mechanics, force fields, chemical;
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Linear-Scaling Techniques in Computational Chemistry and Physics summarizes recent progresses in linear-scaling techniques and their;
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. Annual Reports in Computational Chemistry is a "must" for researchers and students wishing to stay up-to-date on current developments;
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Chemistry provides timely and critical reviews of important topics in computational chemistry as applied to all chemical disciplines. Topics;
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topic of importance to computational chemists. Broad coverage of computational chemistry and up-to-date information Each;
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to bioactive molecules. It looks at various aspects of density functional theory and other issues. Part 2, on Computational Chemistry;
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to bioactive molecules. It looks at various aspects of density functional theory and other issues. Part 2, on Computational Chemistry;
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developments in theoretical and computational chemistry that are applicable to graduate students and research professionals in chemistry, physics;
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The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert;
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These volumes collect the lecture notes of the course An introduction to computational physics held in the academic year 2000/01 for;
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These volumes collect the lecture notes of the course An introduction to computational physics held in the academic year 2000/01 for;
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Covering computational tools in drug design using techniques from chemoinformatics, molecular modelling and computational chemistry, this;
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, material scientists and those who are eager to apply computational chemistry methods to problems of chemical and physical importance. The book is a;
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CONSIDER TO BE THE CENTRAL CORE OF COMPUTATIONAL CHEMISTRY. TUTORIALS AND REVIEWS COVER HOW TO OBTAIN SIMPLE CHEMICAL INSIGHT AND CONCEPTS FROM;
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Not only a major reference work for sale to the library market, Reviews in Computational Chemistry is now a purchase by individuals due to;
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topics ranging from atomistic modeling of surface plasmon resonances to computational organofluorine chemistry ;
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THIS VOLUME, LIKE THOSE PRIOR TO IT, FEATURES CHAPTERS BY EXPERTS IN VARIOUS FIELDS OF COMPUTATIONAL CHEMISTRY. TOPICS COVERED IN VOLUME 20;
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This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Topics covered in volume 21;
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