From Chemical Topology to Three-Dimensional Geometry
Even high-speed supercomputers cannot easily convert traditional two-dimensional databases from chemical topology into the three-dimensional ones demanded by today's chemists, particularly those working in drug design. This fascinating volume resolves this problem by positing mathematical and t...
| Συγγραφή απο Οργανισμό/Αρχή: | |
|---|---|
| Άλλοι συγγραφείς: | |
| Μορφή: | Ηλεκτρονική πηγή Ηλ. βιβλίο |
| Γλώσσα: | English |
| Έκδοση: |
Boston, MA :
Springer US,
2002.
|
| Σειρά: | Topics in Applied Chemistry
|
| Θέματα: | |
| Διαθέσιμο Online: | Full Text via HEAL-Link |
Πίνακας περιεχομένων:
- From Chemical Graphs to 3D Molecular Modeling
- Descriptors of Molecular Shape in 3D
- 3D Molecular Design
- Use of Graph-Theoretic and Geometrical Molecular Descriptors in Structure-Activity Relationships
- Recognition of Membrane Protein Structure from Amino Acid Sequence
- On Characterization of 3D Molecular Structure
- Chemical Graph Theory of Fullerenes
- Recent Work on Toroidal and Other Exotic Fullerene Structures
- All-Conjugated Carbon Species
- Applications of Topology and Graph Theory in Understanding Inorganic Molecules.
