Insights into the nature of intermolecular interactions in low-energy conformers of perindopril erbumine

Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61389013%3A_____%2F09%3A00323558" target="_blank" >RIV/61389013:_____/09:00323558 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Result language
angličtina
Original language name
Insights into the nature of intermolecular interactions in low-energy conformers of perindopril erbumine
Original language description
The DF-SAPT-DFT approach has been employed to study the contributions to the interaction energy between perindopril and tert-butylamine parts of perindopril erbumine in the four structural arrangements, which have been previously described at the RI-MP2/SVP level of quantum chemical theory.
Czech name
Popis interakcí v nízkoležících konformerech perindopril erbuminu
Czech description
Metoda DF-SAPT-DFT byla použita pro studium příspěvků k interakční energii čtyř dříve popsaných RI-MP2/SVP struktur perindopril erbuminu.

Project
Result was created during the realization of more than one project. More information in the Projects tab.
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>Z - Vyzkumny zamer (s odkazem do CEZ)

Publication year
2009
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Article name in the collection
Recent Advances in Mathematics and Computers in Biology and Chemistry
ISBN
978-960-474-062-8
ISSN
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e-ISSN
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Number of pages
4
Pages from-to
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Publisher name
World Scientific and Engineerin Academy and Society
Place of publication
Athens
Event location
Prague
Event date
Mar 23, 2009
Type of event by nationality
WRD - Celosvětová akce
UT code for WoS article
000265406500029

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