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REVIEWS IN COMPUTATIONAL CHEMISTRY

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Contents of Volume 19 (2003)

• Kenny B. Lipkowitz, Raima Larter, and Thomas R. Cundari, Eds. Preface, pp. v-viii.
• Robert Q. Topper, David L. Freeman, Denise Bergin, and Keirnan R. LaMarche, Computational Techniques and Strategies for Monte Carlo Thermodynamic Calculations, with Applications to Nanoclusters, pp. 1-41.
• David E. Smith and Anthony D. J. Haymet, Computing Hydrophobicity, pp. 43-77.
• Lipeng Sun and William L. Hase, Born-Oppenheimer Direct Dynamics Classical Trajectory Simulations, pp. 79-146.
• Gene Lamm, The Poisson-Boltzmann Equation, pp. 147-365.    Errata in PDF format
• Author Index
• Subject Index

Contents of Volume 20 (2004)

• Kenny B. Lipkowitz, Raima Larter, and Thomas R. Cundari, Eds. Preface, pp. v-viii.
• Sason Shaik and Philippe C. Hiberty, Valence Bond Theory, Its History, Fundamentals, and Applications: A Primer, pp. 1-100.
• Nikita Matsunaga and Shiro Koseki, Modeling of Spin-Forbidden Reactions, pp. 101-152.
• Stefan Grimme, Calculation of the Electronic Spectra of Large Molecules, pp. 153-218.
• Raymond Kapral, Simulating Chemical Waves and Patterns, pp. 219-247.
• Costel Sarbu and Horia F. Pop, Fuzzy Soft-Computing Methods and Their Applications in Chemistry, pp. 249-331.
• Sean Ekins and Peter W. Swaan, Development of Computational Models for Enzymes, Transporters, Channels, and Receptors Relevant To ADME/Tox, pp. 333-415.
• Author Index
• Subject Index

Contents of Volume 21 (2005)

• Kenny B. Lipkowitz, Raima Larter, and Thomas R. Cundari, Eds. Preface, pp. v-ix.
• Roberto Dovesi, Bartolomeo Civalleri, Roberto Orlando, Carla Roetti, and Victor R. Saunders, Ab Initio Quantum Simulation in Solid State Chemistry, pp. 1-125.
• Patrick Bultinck, Xavier Girones, and Ramon Carbo-Dorca, Quantum Molecular Similarity: Theory and Applications, pp. 127-207.
• Jean-Loup Faulon, Donald P. Visco Jr., and Diana Roe, Enumerating Molecules, pp. 209-286.
• David J. Livingstone and David W. Salt, Variable Selection - Spoilt for Choice?, pp. 287-348.
• Nathan A. Baker, Biomolecular Applications of Poisson-Boltzmann Methods, pp. 349-379.
• Baltazar D. Aguda, Georghe Craciun, and Rengul Cetin-Atalay, Data Sources and Computational Approaches for Generating Models of Gene Regulatory Networks, pp. 381-411.
• Author Index
• Subject Index

Contents of Volume 22 (2006)

• Kenny B. Lipkowitz, Thomas R. Cundari, and Valerie J. Gillet, Eds. Preface, pp. v-xi.
• Patrice Koehl, Protein Structure Classification, pp. 1-55.
• Emilio Xavier Esposito, Dror Tobi, and Jeffry D. Madura, Comparative Protein Modeling, pp. 57-167.
• Joan-Emma Shea, Miriam R. Friedel, and Andrij Baumketner, Simulations of Protein Folding, pp. 169-228.
• Marco Saraniti, Shela Aboud, and Robert Eisenberg, The Simulation of Ionic Charge Transport in Biological Ion Channels: An Introduction to Numerical Methods, pp. 229-293.
• C. Matthew Sundling, Nagamani Sukumar, Hongmei Zhang, Mark J. Embrechts, and Curt M. Breneman, Wavelets in Chemistry and Cheminformatics, pp. 295-329.
• Author Index
• Subject Index

Contents of Volume 23 (2007)

• Kenny B. Lipkowitz and Thomas R. Cundari, Eds.
• Christian Ochsenfeld, Jorg Kussmann, and Daniel S. Lambrecht, Linear-Scaling Methods in Quantum Chemistry, pp. 1-82.
• Spiridoula Matsika, Conical Intersections in Molecular Systems, pp. 83-124.
• Antonio Fernandez-Ramos, Benjamin A. Ellingson, Bruce C. Garrett, and Donald G. Truhlar, Variational Transition State Theory with Multidimensional Tunneling, pp. 125-232.
• Roland Faller, Coarse-Grain Modeling of Polymers, pp. 233-262.
• Jeffrey W. Godden and Jurgen Bajorath, Analysis of Chemical Information Content Using Shannon Entropy, pp. 263-289.
• Ovidiu Ivanciuc, Applications of Support Vector Machines in Chemistry, pp. 291-400.
• Donald B. Boyd, How Computational Chemistry Became Important in the Pharmaceutical Industry, pp. 401-451.
• Author Index
• Subject Index

Contents of Volume 24 (2007)

• Kenny B. Lipkowitz and Thomas R. Cundari, Series Eds.
• Martin Schoen and Sabine H. L. Klapp, Nanoconfined Fluids: Soft Matter Between Two and Three Dimensions, pp. 1-509.
• Author Index
• Subject Index

Contents of Volume 25 (2007)

• Kenny B. Lipkowitz and Thomas R. Cundari, Eds.
• Wolfgang Paul, Determining the Glass Transition in Polymer Melts, pp. 1-66.
• Nicholas J. Mosey and Martin H. Mueser, Atomistic Modeling of Friction, pp. 67-124.
• Jeetain Mittal, William P. Krekelberg, Jeffrey R. Errington, and Thomas M. Truskett, Computing Free Volume, Structural Order, and Entropy of Liquids and Glasses, pp. 125-158.
• Laurence E. Fried, The Reactivity of Energetic Materials at Extreme Conditions, pp. 159-189.
• Julio A. Alonso, Magnetic Properties of Atomic Clusters of the Transition Elements, pp. 191-248.
• Laura Gagliardi, Transition Metal- and Actinide-Containing Systems Studied with Multiconfigurational Quantum Chemical Methods, pp. 249-284.
• Hua Guo, Recursive Solutions to Large Eigenproblems in Molecular Spectroscopy and Reaction Dynamics, pp. 285-347.
• Hugh Cartwright, Development and Uses of an Artificial Intelligence in Chemistry, pp. 349-389.
• Author Index
• Subject Index

Contents of Volume 26

• Kenny B. Lipkowitz and Thomas R. Cundari, Eds.
• In preparation.

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Updated October 2007.
Webmaster: Donald B. Boyd, Ph.D., Indiana University-Purdue University at Indianapolis (IUPUI), chem.iupui.edu