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1 Ergebnisse
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Combining machine learning and quantum mechanics yields mor..:
Tortorella, Sara
;
Carosati, Emanuele
;
Sorbi, Giulia
...
Journal of Computational Chemistry. 42 (2021) 29 - p. 2068-2078 , 2021
Link:
https://doi.org/10.1002/jcc.26737
RT Journal T1
Combining machine learning and quantum mechanics yields more chemically aware molecular descriptors for medicinal chemistry applications
UL https://suche.suub.uni-bremen.de/peid=cr-10.1002_jcc.26737&Exemplar=1&LAN=DE A1 Tortorella, Sara A1 Carosati, Emanuele A1 Sorbi, Giulia A1 Bocci, Giovanni A1 Cross, Simon A1 Cruciani, Gabriele A1 Storchi, Loriano PB Wiley YR 2021 SN 0192-8651 SN 1096-987X JF Journal of Computational Chemistry VO 42 IS 29 SP 2068 OP 2078 LK http://dx.doi.org/https://doi.org/10.1002/jcc.26737 DO https://doi.org/10.1002/jcc.26737 SF ELIB - SuUB Bremen
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