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Record Nr. |
UNINA9910143226103321 |
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Titolo |
Reviews in computational chemistry . Volume 18 [[electronic resource] /] / edited by Kenny B. Lipkowitz and Donald B. Boyd |
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Pubbl/distr/stampa |
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New York, N.Y., : Wile-VCH, c2002 |
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ISBN |
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1-280-36682-6 |
9786610366828 |
0-470-34940-9 |
0-471-46142-3 |
0-471-43351-9 |
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Descrizione fisica |
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1 online resource (384 p.) |
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Collana |
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Reviews in computational chemistry ; ; v. 18 |
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Altri autori (Persone) |
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BoydDonald B |
LipkowitzKenny B |
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Disciplina |
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Soggetti |
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Chemistry - Data processing |
Chemistry - Mathematics |
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Lingua di pubblicazione |
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Formato |
Materiale a stampa |
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Livello bibliografico |
Monografia |
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Note generali |
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Description based upon print version of record. |
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Nota di bibliografia |
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Includes bibliographical references and index. |
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Nota di contenuto |
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Reviews in Computational Chemistry Volume 18; Preface; Epilogue and Dedication; Contents; Contributors; Contributors to Previous Volumes*; Topics Covered in Volumes 1-18*; 1. Clustering Methods and Their Uses in Computational Chemistry; 2. The Use of Scoring Functions in Drug Discovery Applications; 3. Potentials and Algorithms for Incorporating Polarizability in Computer Simulations; 4. New Developments in the Theoretical Description of Charge-Transfer Reactions in Condensed Phases; 5. Linear Free Energy Relationships Using Quantum Mechanical Descriptors |
6. The Development of Computational Chemistry in GermanyAppendix. Examination of the Employment Environment for Computational Chemistry; Author Index; Subject Index |
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Sommario/riassunto |
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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 18 include molecular modeling, computer-assisted molecular design (camd), quantum chemistry, molecular mechanics and dynamics, and |
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