Fundamental Principles of Molecular Modeling [E-Book] / edited by Werner Gans, Anton Amann, Jan C. A. Boeyens
Molecular similarity has always been an important conceptual tool of chemists, yet systematic approaches to molecular similarity problems have only recently been recognized as a major contributor to our understanding of molecular properties. Advanced approaches to molecular similarity analysis have...
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Full text |
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Personal Name(s): | Amann, Anton, editor |
Boeyens, Jan C. A., editor / Gans, Werner, editor | |
Imprint: |
Boston, MA :
Springer,
1996
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Physical Description: |
IX, 249 p. online resource. |
Note: |
englisch |
ISBN: |
9781489902122 |
DOI: |
10.1007/978-1-4899-0212-2 |
Subject (LOC): |
- Fundamentals of Molecular Modelling
- Molecular Shape
- New Tests of Models in Chemical Binding — Extra-Mechanical Effects and Molecular Properties
- Can Quantum Mechanics Account for Chemical Structures?
- Environmental Factors in Molecular Modelling
- Knowledge Acquisition from Crystallographic Databases: Applications in Molecular Modelling, Crystal Engineering and Structural Chemistry
- Hydrogen Bonding Models: Their Relevance to Molecular Modeling
- Molecular Electrostatic Properties from X-Ray Diffraction Data
- Modeling of Structural and Spectroscopic Properties of Transition Metal Compounds
- Conformational Analysis of Long Chain Seco-Acids Used in Woodward’s Total Synthesis of Erythromycin A — Conformational Space Search as the Basis of Molecular Modeling
- Packing Molecules and Ions into Crystals
- On the Isostructurality of Supramolecules: Packing Similarities Governed by Molecular Complementarity
- The Phenomenon of Conglomerate Crystallization. Part 44. Counterion Control of Crystallization Pathway Selection
- Contributors.