Datorbaserad analys av enzymdesign för Diels-Alder reaktioner
This thesis has been focused around the Diels Alder reaction with the goal to design an enzyme catalyzed reaction pathway. To achieve this goal computer aided enzyme design was utilized. Common traditional methods of computational chemistry (B3LYP, MP2) do not do well when calculating reaction barr...
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| Format: | Others |
| Language: | Swedish |
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KTH, Skolan för kemivetenskap (CHE)
2011
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| Online Access: | http://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-34153 |