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Macrocycle Conformational Sampling by DFT-D3/COSMO-RS Methodology

  1. 1.
    Gutten, Ondrej - Bím, Daniel - Řezáč, Jan - Rulíšek, Lubomír
    Macrocycle Conformational Sampling by DFT-D3/COSMO-RS Methodology.
    Journal of Chemical Information and Modeling. Roč. 58, č. 1 (2018), s. 48-60. ISSN 1549-9596. E-ISSN 1549-960X
    OECD category: Physical chemistry
    Impact factor: 3.966, year: 2018
    http://hdl.handle.net/11104/0283913
Number of the records: 1  

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