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A total conformational analysis of diastereomeric esters and calculation of their conformational shielding modelsTamp, Sven; Danilas, Kady; Kreen, Malle; Vares, Lauri; Kiirend, Ene; Vija, Sirje; Pehk, Tõnis; Parve, Omar; Metsala, AndrusJournal of molecular structure : THEOCHEM2008 / 1/3, p. 84-91 : ill https://www.researchgate.net/publication/244272489_A_total_conformational_analysis_of_diastereomeric_esters_and_calculation_of_their_conformational_shielding_models

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An assessment of alternative low level calculation methods for the initial selection of conformers of diastereomeric estersMetsala, Andrus; Tamp, Sven; Danilas, Kady; Lille, Ülo; Villo, Ly; Vija, Sirje; Pehk, Tõnis; Parve, OmarJournal of theoretical chemistry2014 / p. 1-10 : ill

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book article

Conformity analysis with structured query languageLiiv, Innar; Kuusik, Rein, inform.; Võhandu, Leo6th WSEAS International Conference on Artificial Intelligence, Knowledge Engineering and Data Bases : Corfu Island, Greece, February 16-19, 20072007 / p. 187-189 https://www.academia.edu/3807457/Conformity_analysis_with_structured_query_language

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journal article

Improved efficiency of focal point conformational analysis with truncated correlation consistent basis setsKahn, Kalju; Kahn, IirisJournal of computational chemistry2008 / 6, p. 900-911 https://onlinelibrary.wiley.com/doi/abs/10.1002/jcc.20848

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journal article

Quantum chemical evaluation of the yield of hydroxybenzophenones in the Fries rearrangement of hydroxyphenyl benzoatesMetsala, Andrus; Usin, Eve; Vallikivi, Imre; Villo, Ly; Pehk, Tõnis; Parve, OmarJournal of molecular structure : THEOCHEM2004 / p. 215-221 : ill https://www.sciencedirect.com/science/article/pii/S016612800400750X

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journal article EST / journal article ENG

Reaction path scans : Aza-Michael reactions of isatin iminesMetsala, Andrus; Žari, Sergei; Kanger, TõnisComputational and theoretical chemistry2017 / p. 30-40 : ill https://doi.org/10.1016/j.comptc.2017.07.014 Journal metrics at Scopus Article at Scopus Journal metrics at WOS Article at WOS

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journal article EST / journal article ENG

Supramolecular chirogenesis in a sterically hindered porphyrin: a critical theoretical analysisOsadchuk, Irina; Luts, Hanna-Eliisa; Norvaiša, Karolis; Borovkov, Victor; Senge, Mathias O.Chemistry : a European journal2023 / art. e202302275 https://doi.org/10.1002/chem.202302275 Journal metrics at Scopus Article at Scopus Journal metrics at WOS Article at WOS

journal article EST / journal article ENG