Reaction path scans : Aza-Michael reactions of isatin imines
Metsala, Andrus
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Žari, Sergei
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Kanger, Tõnis
Computational and theoretical chemistry
2017
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p. 30-40 : ill
https://doi.org/10.1016/j.comptc.2017.07.014
https://www.scopus.com/sourceid/21000196008
https://www.scopus.com/record/display.uri?eid=2-s2.0-85026372103&origin=inward&txGid=ea27d06255d5674b196256f0973611fd
https://jcr.clarivate.com/jcr-jp/journal-profile?journal=COMPUT%20THEOR%20CHEM&year=2017
https://www.webofscience.com/wos/woscc/full-record/WOS:000412250300004
Shortfall of B3LYP in reproducing NMR JCH couplings in some isomeric epoxy structures with strong stereoelectronic effects : a benchmark study on DFT functionals
Adamson, Jasper
;
Nazarski, Ryszard B.
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Jarvet, Jüri
;
Pehk, Tõnis
;
Aav, Riina
ChemPhysChem
2018
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p. 631-642 : ill
https://doi.org/10.1002/cphc.201701125
https://www.scopus.com/sourceid/26588
https://www.scopus.com/record/display.uri?eid=2-s2.0-85040666373&origin=inward&txGid=acc32b0dcf9e5d61dce0ecb74f46d1fd
https://jcr.clarivate.com/jcr-jp/journal-profile?journal=CHEMPHYSCHEM&year=2022
https://www.webofscience.com/wos/woscc/full-record/WOS:000426608900012