The UTN program
We give an algorithm which goal is to find the energy barrier between a given pair of points in a graph which represents the conformational space of a molecule. If the conformational space is homeomorphic to an -dimensional torus, then the graph can be chosen of a particular form. The UTN software,...
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| Main Authors: | , , , |
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| Format: | Online |
| Izdano: |
Firenze University Press
2021
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| Teme: | |
| Online dostop: | 49308 |
| Oznake: |
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