|  | | Matta, Chérif F. (ed.)
Quantum Biochemistry
ISBN-10: 3-527-32322-8
ISBN-13: 978-3-527-32322-7
Heine, Thomas / Joswig, Jan-Ole / Gelessus, Achim
Computational Chemistry Workbook
Learning Through Examples
ISBN-10: 3-527-32442-9
ISBN-13: 978-3-527-32442-2
Comba, Peter / Hambley, Trevor W. / Martin, Bodo
Molecular Modeling of Inorganic Compounds
ISBN-10: 3-527-31799-6
ISBN-13: 978-3-527-31799-8
Young, D. C.
Computational Drug Design
A Guide for Computational and Medicinal Chemists
ISBN-10: 0-470-12685-X
ISBN-13: 978-0-470-12685-1
Lackey, Karen
Gene Family Targeted Molecular Design
ISBN-10: 0-470-41289-5
ISBN-13: 978-0-470-41289-3
Velten, Kai
Mathematical Modeling and Simulation
Introduction for Scientists and Engineers
ISBN-10: 3-527-40758-8
ISBN-13: 978-3-527-40758-3
Hinchliffe, Alan
Molecular Modelling for Beginners
ISBN-10: 0-470-51313-6
ISBN-13: 978-0-470-51313-2
Hinchliffe, Alan
Molecular Modelling for Beginners
ISBN-10: 0-470-51314-4
ISBN-13: 978-0-470-51314-9
Seavey, Kevin / Liu, Y. A.
Step-Growth Polymerization Process Modeling and Product Design
ISBN-10: 0-470-23823-2
ISBN-13: 978-0-470-23823-3
Öchsner, Andreas / Murch, Graeme E. / de Lemos, Marcelo J. S. (eds.)
Cellular and Porous Materials
Thermal Properties Simulation and Prediction
ISBN-10: 3-527-31938-7
ISBN-13: 978-3-527-31938-1
Morokuma, Keiji / Musaev, Djamaladdin G. (eds.)
Computational Modeling for Homogeneous and Enzymatic Catalysis
A Knowledge-Base for Designing Efficient Catalysts
ISBN-10: 3-527-31843-7
ISBN-13: 978-3-527-31843-8
Schneider, Gisbert / Baringhaus, Karl-Heinz
Molecular Design
Concepts and Applications
ISBN-10: 3-527-31432-6
ISBN-13: 978-3-527-31432-4
Höltje, Hans-Dieter / Sippl, Wolfgang / Rognan, Didier / Folkers, Gerd
Molecular Modeling
Basic Principles and Applications
ISBN-10: 3-527-31568-3
ISBN-13: 978-3-527-31568-0
Mennucci, Benedetta / Cammi, Roberto (eds.)
Continuum Solvation Models in Chemical Physics
From Theory to Applications
ISBN-10: 0-470-02938-2
ISBN-13: 978-0-470-02938-1
Bachrach, Steven M.
Computational Organic Chemistry
ISBN-10: 0-471-71342-2
ISBN-13: 978-0-471-71342-5
Ponniah, Paulraj
Data Modeling Fundamentals
A Practical Guide for IT Professionals
ISBN-10: 0-471-79049-4
ISBN-13: 978-0-471-79049-5
Mishnaevsky, Leon L.
Computational Mesomechanics of Composites
Numerical Analysis of the Effect of Microstructures of Composites of Strength and Damage Resistance
ISBN-10: 0-470-02764-9
ISBN-13: 978-0-470-02764-6
Dobre, Tanase Gh. / Sanchez Marcano, Jose G.
Chemical Engineering
Modelling, Simulation and Similitude
ISBN-10: 3-527-30607-2
ISBN-13: 978-3-527-30607-7
Billo, E. Joseph
Excel for Scientists and Engineers
Numerical Methods
ISBN-10: 0-471-38734-7
ISBN-13: 978-0-471-38734-3
Lipkowitz, Kenneth B. / Cundari, Thomas R. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 23
ISBN-10: 0-470-08201-1
ISBN-13: 978-0-470-08201-0
Rode, Bernd Michael / Hofer, Thomas S. / Kugler, Michael D.
The Basics of Theoretical and Computational Chemistry
ISBN-10: 3-527-31773-2
ISBN-13: 978-3-527-31773-8
Ullmann's Modeling and Simulation
ISBN-10: 3-527-31605-1
ISBN-13: 978-3-527-31605-2
Jensen, Frank
Introduction to Computational Chemistry
ISBN-10: 0-470-01187-4
ISBN-13: 978-0-470-01187-4
van Santen, Rutger A. / Neurock, Matthew
Molecular Heterogeneous Catalysis
A Conceptual and Computational Approach
ISBN-10: 3-527-29662-X
ISBN-13: 978-3-527-29662-0
Tramontano, Anna
Protein Structure Prediction
Concepts and Applications
ISBN-10: 3-527-31167-X
ISBN-13: 978-3-527-31167-5
Dronskowski, Richard
Computational Chemistry of Solid State Materials
A Guide for Materials Scientists, Chemists, Physicists and others
ISBN-10: 3-527-31410-5
ISBN-13: 978-3-527-31410-2
Galiatsatos, Vassilios
Molecular Simulation Methods for Predicting Polymer Properties
ISBN-10: 0-471-46481-3
ISBN-13: 978-0-471-46481-5
Buchner, Johannes / Kiefhaber, Thomas (eds.)
Protein Folding Handbook
ISBN-10: 3-527-30784-2
ISBN-13: 978-3-527-30784-5
Cramer, Christopher J.
Essentials of Computational Chemistry
Theories and Models
ISBN-10: 0-470-09182-7
ISBN-13: 978-0-470-09182-1
Hancock, John M. / Zvelebil, Marketa J. (eds.)
Dictionary of Bioinformatics and Computational Biology
ISBN-10: 0-471-43622-4
ISBN-13: 978-0-471-43622-5
Raabe, Dierk / Roters, Franz / Barlat, Frédéric / Chen, Long-Qing (eds.)
Continuum Scale Simulation of Engineering Materials
Fundamentals - Microstructures - Process Applications
ISBN-10: 3-527-30760-5
ISBN-13: 978-3-527-30760-9
Paschedag, Anja R.
CFD in der Verfahrenstechnik
Allgemeine Grundlagen und mehrphasige Anwendungen
ISBN-10: 3-527-30994-2
ISBN-13: 978-3-527-30994-8
Gasteiger, Johann / Engel, Thomas (eds.)
Chemoinformatics
A Textbook
ISBN-10: 3-527-30681-1
ISBN-13: 978-3-527-30681-7
Roters, Franz / Eisenlohr, Philip / Bieler, Thomas R. / Raabe, Dierk
Crystal Plasticity Finite Element Methods
in Materials Science and Engineering
ISBN-10: 3-527-32447-X
ISBN-13: 978-3-527-32447-7
Provatas, Nikolas / Elder, Ken
Phase-Field Methods in Materials Science and Engineering
ISBN-10: 3-527-40747-2
ISBN-13: 978-3-527-40747-7
Bersuker, Isaac B.
Electronic Structure and Properties of Transition Metal Compounds
Introduction to the Theory
ISBN-10: 0-470-18023-4
ISBN-13: 978-0-470-18023-5
Guha, Rajarshi / Bender, Andreas (eds.)
Computational Approaches in Cheminformatics and Bioinformatics
ISBN-10: 0-470-38441-7
ISBN-13: 978-0-470-38441-1
Gujrati, Purushottam D. / Leonov, Arkady I. (eds.)
Modeling and Simulation in Polymers
ISBN-10: 3-527-32415-1
ISBN-13: 978-3-527-32415-6
Ancheyta, J.
Modeling and Simulation of Catalytic Reactors for Petroleum Refining
ISBN-10: 0-470-18530-9
ISBN-13: 978-0-470-18530-8
Rankovic, Zoran / Morphy, Richard
Lead Generation Approaches in Drug Discovery
ISBN-10: 0-470-25761-X
ISBN-13: 978-0-470-25761-6
King, Michael / Gee, David
Multiscale Modeling of Particle Interactions
Applications in Biology and Nanotechnology
ISBN-10: 0-470-24235-3
ISBN-13: 978-0-470-24235-3
Krishnan, Kannan / Andersen, Melvin (eds.)
Quantitative Modeling in Toxicology
ISBN-10: 0-470-99809-1
ISBN-13: 978-0-470-99809-0
Miller, Benjamin L. (ed.)
Dynamic Combinatorial Chemistry
In Drug Discovery, Bioorganic Chemistry, and Materials Science
ISBN-10: 0-470-09603-9
ISBN-13: 978-0-470-09603-1
Feig, Michael (ed.)
Modeling Solvent Environments
Applications to Simulations of Biomolecules
ISBN-10: 3-527-32421-6
ISBN-13: 978-3-527-32421-7
Salam, Akbar
Molecular Quantum Electrodynamics
Long-Range Intermolecular Interactions
ISBN-10: 0-470-25930-2
ISBN-13: 978-0-470-25930-6
Magnasco, Valerio
Methods of Molecular Quantum Mechanics
An Introduction to Electronic Molecular Structure
ISBN-10: 0-470-68441-0
ISBN-13: 978-0-470-68441-2
Magnasco, Valerio
Methods of Molecular Quantum Mechanics
An Introduction to Electronic Molecular Structure
ISBN-10: 0-470-68442-9
ISBN-13: 978-0-470-68442-9
Sholl, David / Steckel, Janice A
Density Functional Theory
A Practical Introduction
ISBN-10: 0-470-37317-2
ISBN-13: 978-0-470-37317-0
Meyer, Hans-Dieter / Gatti, Fabien / Worth, Graham A. (eds.)
Multidimensional Quantum Dynamics
MCTDH Theory and Applications
ISBN-10: 3-527-32018-0
ISBN-13: 978-3-527-32018-9
Clymer, John R.
Simulation-Based Engineering of Complex Systems
ISBN-10: 0-470-40129-X
ISBN-13: 978-0-470-40129-3
Gu, Jenny / Bourne, Philip E. (eds.)
Structural Bioinformatics
ISBN-10: 0-470-18105-2
ISBN-13: 978-0-470-18105-8
Ansorge, Rainer / Sonar, Thomas
Mathematical Models of Fluid Dynamics
Modeling, Theory, Basic Numerical Facts - An Introduction
ISBN-10: 3-527-40774-X
ISBN-13: 978-3-527-40774-3
Reiher, Markus / Wolf, Alexander
Relativistic Quantum Chemistry
The Fundamental Theory of Molecular Science
ISBN-10: 3-527-31292-7
ISBN-13: 978-3-527-31292-4
Fliszar, Sandor
Atomic Charges, Bond Properties, and Molecular Energies
ISBN-10: 0-470-37622-8
ISBN-13: 978-0-470-37622-5
Yuryev, Anton (ed.)
Pathway Analysis for Drug Discovery
Computational Infrastructure and Applications
ISBN-10: 0-470-10705-7
ISBN-13: 978-0-470-10705-8
Herlach, Dieter M. (ed.)
Phase Transformations in Multicomponent Melts
ISBN-10: 3-527-31994-8
ISBN-13: 978-3-527-31994-7
Stewart, Warren E. / Caracotsios, Michael
Computer-Aided Modeling of Reactive Systems
ISBN-10: 0-470-27495-6
ISBN-13: 978-0-470-27495-8
Ross, Richard B. / Mohanty, Sanat (eds.)
Multiscale Simulation Methods for Nanomaterials
ISBN-10: 0-470-10528-3
ISBN-13: 978-0-470-10528-3
Shaik, Sason S. / Hiberty, Philippe C.
The Chemist's Guide to Valence Bond Theory
ISBN-10: 0-470-03735-0
ISBN-13: 978-0-470-03735-5
Ekins, Sean (ed.)
Computational Toxicology
Risk Assessment for Pharmaceutical and Environmental Chemicals
ISBN-10: 0-470-04962-6
ISBN-13: 978-0-470-04962-4
Mazziotti, David A. / Prigogine, I. / Rice, Stuart A. (eds.)
Advances in Chemical Physics
Volume 134: Reduced-Density-Matrix Mechanics. With Application to Many-Electron Atoms and Molecules
ISBN-10: 0-471-79056-7
ISBN-13: 978-0-471-79056-3
Gottstein, Günter (ed.)
Integral Materials Modeling
Towards Physics-Based Through-Process Models
ISBN-10: 3-527-31711-2
ISBN-13: 978-3-527-31711-0
Vedmedenko, Elena
Competing Interactions and Patterns in Nanoworld
ISBN-10: 3-527-40484-8
ISBN-13: 978-3-527-40484-1
Li, Fan
Developing Chemical Information Systems
An Object-Oriented Approach Using Enterprise Java
ISBN-10: 0-471-75157-X
ISBN-13: 978-0-471-75157-1
Piprek, Joachim (ed.)
Nitride Semiconductor Devices: Principles and Simulation
ISBN-10: 3-527-40667-0
ISBN-13: 978-3-527-40667-8
Matta, Chérif F. / Boyd, Russell J. (eds.)
The Quantum Theory of Atoms in Molecules
From Solid State to DNA and Drug Design
ISBN-10: 3-527-30748-6
ISBN-13: 978-3-527-30748-7
Hirsch, Jürgen (ed.)
Virtual Fabrication of Aluminum Products
Microstructural Modeling in Industrial Aluminum Production
ISBN-10: 3-527-31363-X
ISBN-13: 978-3-527-31363-1
Jahnke, Wolfgang / Erlanson, Daniel A. (eds.)
Fragment-based Approaches in Drug Discovery
ISBN-10: 3-527-31291-9
ISBN-13: 978-3-527-31291-7
Langer, Thierry / Hoffmann, Remy D. (eds.)
Pharmacophores and Pharmacophore Searches
ISBN-10: 3-527-31250-1
ISBN-13: 978-3-527-31250-4
Rognan, Didier (ed.)
Ligand Design for G Protein-coupled Receptors
ISBN-10: 3-527-31284-6
ISBN-13: 978-3-527-31284-9
Kaupp, Martin / Bühl, Michael / Malkin, Vladimir G. (eds.)
Calculation of NMR and EPR Parameters
Theory and Applications
ISBN-10: 3-527-30779-6
ISBN-13: 978-3-527-30779-1
Chau, Foo-Tim / Liang, Yi-Zeng / Gao, Junbin / Shao, Xue-Guang
Chemometrics
From Basics to Wavelet Transform
ISBN-10: 0-471-20242-8
ISBN-13: 978-0-471-20242-4
Rogers, Donald W.
Computational Chemistry Using the PC
ISBN-10: 0-471-42800-0
ISBN-13: 978-0-471-42800-8
Kee, Robert J. / Coltrin, Michael E. / Glarborg, Peter
Chemically Reacting Flow
Theory and Practice
ISBN-10: 0-471-26179-3
ISBN-13: 978-0-471-26179-7
Carloni, Paolo / Alber, Frank (eds.)
Quantum Medicinal Chemistry
ISBN-10: 3-527-30456-8
ISBN-13: 978-3-527-30456-1
Pretsch, Ernö / Tóth, Gábór / Munk, Morton E. / Badertscher, Martin
Computer-Aided Structure Elucidation
Spectra Interpretation and Structure Generation
ISBN-10: 3-527-30640-4
ISBN-13: 978-3-527-30640-4
Young, David
Computational Chemistry
A Practical Guide for Applying Techniques to Real World Problems
ISBN-10: 0-471-33368-9
ISBN-13: 978-0-471-33368-5
Hinchliffe, Alan
Modelling Molecular Structures
ISBN-10: 0-471-48993-X
ISBN-13: 978-0-471-48993-1
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 14
ISBN-10: 0-471-35495-3
ISBN-13: 978-0-471-35495-6
Hinchliffe, Alan
Chemical Modeling
From Atoms to Liquids
ISBN-10: 0-471-99903-2
ISBN-13: 978-0-471-99903-4
Hinchliffe, Alan
Chemical Modeling
From Atoms to Liquids
ISBN-10: 0-471-99904-0
ISBN-13: 978-0-471-99904-1
Zupan, Jure / Gasteiger, Johann
Neural Networks in Chemistry and Drug Design
An Introduction
ISBN-10: 3-527-29779-0
ISBN-13: 978-3-527-29779-5
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 13
ISBN-10: 0-471-33135-X
ISBN-13: 978-0-471-33135-3
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 12
ISBN-10: 0-471-24671-9
ISBN-13: 978-0-471-24671-8
von Ragué Schleyer, Paul (ed.)
Encyclopedia of Computational Chemistry
ISBN-10: 0-471-96588-X
ISBN-13: 978-0-471-96588-6
Klapötke, Thomas M. / Schulz, Axel
Quantum Chemical Methods in Main-Group Chemistry
ISBN-10: 0-471-97242-8
ISBN-13: 978-0-471-97242-6
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 11
ISBN-10: 0-471-19248-1
ISBN-13: 978-0-471-19248-0
Springborg, Michael (ed.)
Density-Functional Methods in Chemistry and Materials Science
ISBN-10: 0-471-96759-9
ISBN-13: 978-0-471-96759-0
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 10
ISBN-10: 0-471-18648-1
ISBN-13: 978-0-471-18648-9
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 9
ISBN-10: 0-471-18639-2
ISBN-13: 978-0-471-18639-7
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 8
ISBN-10: 0-471-18638-4
ISBN-13: 978-0-471-18638-0
Jurs, Peter C.
Computer Software Applications in Chemistry
ISBN-10: 0-471-10587-2
ISBN-13: 978-0-471-10587-9
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 7
ISBN-10: 0-471-18628-7
ISBN-13: 978-0-471-18628-1
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 6
ISBN-10: 0-471-18596-5
ISBN-13: 978-0-471-18596-3
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 5
ISBN-10: 0-471-18866-2
ISBN-13: 978-0-471-18866-7
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 4
ISBN-10: 0-471-18854-9
ISBN-13: 978-0-471-18854-4
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 3
ISBN-10: 0-471-18853-0
ISBN-13: 978-0-471-18853-7
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 2
ISBN-10: 0-471-18810-7
ISBN-13: 978-0-471-18810-0
Lipkowitz, Kenneth B. / Boyd, Donald B. (eds.)
Reviews in Computational Chemistry
Volume 1
ISBN-10: 0-471-18728-3
ISBN-13: 978-0-471-18728-8
Kutzelnigg, Werner
Einführung in die Theoretische Chemie
ISBN-10: 3-527-30609-9
ISBN-13: 978-3-527-30609-1
Calais, Jean-Louis
Quantum Chemistry Workbook
Basic Concepts and Procedures in the Theory of the Electronic Structure of Matter
ISBN-10: 0-471-59435-0
ISBN-13: 978-0-471-59435-2
Jurs, Peter C. / Isenhour, Thomas L. / Wilkins, Charles L.
BASIC Programming for Chemists
An Introduction
ISBN-10: 0-471-85613-4
ISBN-13: 978-0-471-85613-9
Ratzlaff, Kenneth L.
Introduction to Computer-Assisted Experimentation
ISBN-10: 0-471-86525-7
ISBN-13: 978-0-471-86525-4
Clark, Tim
A Handbook of Computational Chemistry
A Practical Guide to Chemical Structure and Energy Calculations
ISBN-10: 0-471-88211-9
ISBN-13: 978-0-471-88211-4
Goltz, Mark / Huang, Junqi
Analytical Modeling of Solute Transport in Groundwater
Using Models to Understand the Effect of Natural Processes on Contaminant Fate and Transport i
ISBN-10: 0-470-24234-5
ISBN-13: 978-0-470-24234-6
Barone, Vincenzo (ed.)
Computational Spectroscopy
Status and Perspectives
ISBN-10: 0-470-47017-8
ISBN-13: 978-0-470-47017-6
Allinger, Norman L.
Molecular Structure
Understanding Steric and Electronic Effects from Molecular Mechanics
ISBN-10: 0-470-19557-6
ISBN-13: 978-0-470-19557-4
Lipkowitz, Kenneth B.
Reviews in Computational Chemistry, Volume 27
ISBN-10: 0-470-58714-8
ISBN-13: 978-0-470-58714-0
Souza de Cursi, Eduardo / Sampaio, Rubens
Modeling and Convexity
ISBN-10: 1-84821-177-5
ISBN-13: 978-1-84821-177-3
Klages, Rainer / Radons, Günter / Sokolov, Igor M. (eds.)
Anomalous Transport
Foundations and Applications
ISBN-10: 3-527-40722-7
ISBN-13: 978-3-527-40722-4
Jensen, Frank
Introduction to Computational Chemistry
ISBN-10: 0-470-01186-6
ISBN-13: 978-0-470-01186-7
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