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1 Ergebnisse
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Distribution of Bound Conformations in Conformational Ensem..:
Han, Fengyang
;
Hao, Dongxiao
;
He, Xibing
...
Journal of Chemical Information and Modeling. 63 (2023) 21 - p. 6608-6618 , 2023
Link:
https://doi.org/10.1021/acs.jcim.3c01350
RT Journal T1 <Title>Distribution of Bound Conformations in Conformational Ensembles for X-ray Ligands Predicted by the ANI-2X Machine Learning Potential</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jcim.3c01350&Exemplar=1&LAN=DE A1 Han, Fengyang A1 Hao, Dongxiao A1 He, Xibing A1 Wang, Luxuan A1 Niu, Taoyu A1 Wang, Junmei PB American Chemical Society (ACS) YR 2023 SN 1549-9596 SN 1549-960X JF Journal of Chemical Information and Modeling VO 63 IS 21 SP 6608 OP 6618 LK http://dx.doi.org/https://doi.org/10.1021/acs.jcim.3c01350 DO https://doi.org/10.1021/acs.jcim.3c01350 SF ELIB - SuUB Bremen
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