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Structure and IR spectrum of phenylalanyl-glycyl-glycine tripetide in the gas-phase: IR/UV experiments, ab initio quantum chemical calculations, and molecular dynamic Simulations

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388963%3A_____%2F05%3A00025723" target="_blank" >RIV/61388963:_____/05:00025723 - isvavai.cz</a>

  • Result on the web

  • DOI - Digital Object Identifier

Alternative languages

  • Result language

    angličtina

  • Original language name

    Structure and IR spectrum of phenylalanyl-glycyl-glycine tripetide in the gas-phase: IR/UV experiments, ab initio quantum chemical calculations, and molecular dynamic Simulations

  • Original language description

    We investigated the potential-energy surface (PES) of the phenylalanyl-glycyl-glycine tripeptide in the gas phase by means of IR/UV double-resonance spectroscopy, and quantum chemical and statistical thermodynamic calculations.

  • Czech name

    Struktura a IR spektrum phenylalanyl-glycyl-glycine tripetidu v plynné fázi: IR/UV experimenty, ab initio kvantově chemické výpočty a molekulárně dynamické simulace

  • Czech description

    Zkoumali jsme hyperplochu potenciální energie (PES) phenylalanyl-glycyl-glycine tripeptidu v plynné fázi metodami IR/UV rezonanční spektroskopie a výpočty založenými na principech kvantové chemie a statistické termodynamiky.

Classification

  • Type

    J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

  • CEP classification

    CF - Physical chemistry and theoretical chemistry

  • OECD FORD branch

Result continuities

  • 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)

Others

  • Publication year

    2005

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Chemistry European Journal

  • ISSN

    0947-6539

  • e-ISSN

  • Volume of the periodical

    11

  • Issue of the periodical within the volume

    23

  • Country of publishing house

    DE - GERMANY

  • Number of pages

    14

  • Pages from-to

    6804-6817

  • UT code for WoS article

  • EID of the result in the Scopus database