Computational chemistry using the PC / Donald W. Rogers

Por: Rogers, Donald WTipo de material: TextoTextoDetalles de publicación: Hoboken : Wiley-Interscience, 2003 Edición: 3rd ed.Descripción: XX, 349 p. ; 24 cmISBN: 0-471-42800-0Tema(s): Química -- Proceso de datos | Química computacionalResumen: This book focuses on the theory and applications of molecular modeling. It provides a textbook that is useable by both graduate students and professionals in the field. Enables the user to conduct research-level calculations using readily available software packages, and many learning tools are available on an accompanying website. Provides the reader with a broad understanding of the theories of computational chemistry and the jargon of the trade. Allows the reader to critically evaluate computed results from personal research or information available in the literature
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This book focuses on the theory and applications of molecular modeling. It provides a textbook that is useable by both graduate students and professionals in the field. Enables the user to conduct research-level calculations using readily available software packages, and many learning tools are available on an accompanying website. Provides the reader with a broad understanding of the theories of computational chemistry and the jargon of the trade. Allows the reader to critically evaluate computed results from personal research or information available in the literature

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