| Description |
1 online resource (xxix, 418 pages) : illustrations |
| Series |
Reviews in computational chemistry ; 25 |
| Contents |
Frontmatter -- Determining the Glass Transition in Polymer Melts / Wolfgang Paul -- Atomistic Modeling of Friction / Nicholas J Mosey, Martin H Müser -- Computing Free Volume, Structural Order, and Entropy of Liquids and Glasses / Jeetain Mittal, William P Krekelberg, Jeffrey R Errington, Thomas M Truskett -- The Reactivity of Energetic Materials at Extreme Conditions / Laurence E Fried -- Magnetic Properties of Atomic Clusters of the Transition Elements / Julio A Alonso -- Trransition Metal- and Actinide-Containing Systems Studied with Multiconfigurational Quantum Chemical Methods / Laura Gagliardi -- Recursive Solutions to Large Eigenproblems in Molecular Spectroscopy and Reaction Dynamics / Hua Guo -- Development and Uses of Artificial Intelligence in Chemistry / Hugh Cartwright |
| Bibliography |
Includes bibliographical references and indexes |
| Notes |
Print version record |
| Subject |
Chemistry -- Data processing.
|
|
Chemistry -- Mathematics.
|
|
Cheminformatics.
|
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SCIENCE -- Chemistry -- Clinical.
|
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Cheminformatics
|
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Chemistry -- Data processing
|
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Chemistry -- Mathematics
|
| Form |
Electronic book
|
| Author |
Lipkowitz, Kenny B
|
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Boyd, Donald B
|
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Cundari, Thomas R., 1964-
|
| ISBN |
9780470189061 |
|
0470189061 |
|
9780470189078 |
|
047018907X |
|
0470179988 |
|
9780470179987 |
|
