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Transition Path Sampling Study of the Reaction Catalyzed by Purine Nucleoside Phosphorylase
The Transition Path Sampling (TPS) method is a powerful technique for studying rare events in complex systems, that allows description of reactive events in atomic detail without prior knowledge of reaction coordinates and transition states. We have applied TPS in combination with a hybrid Quantum M...
में बचाया:
| मुख्य लेखकों: | , , |
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| स्वरूप: | Artigo |
| भाषा: | Inglês |
| प्रकाशित: |
2008
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| विषय: | |
| ऑनलाइन पहुंच: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2909608/ https://ncbi.nlm.nih.gov/pubmed/20664707 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1524/zpch.2008.5395 |
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