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"Ensemble Simulations and Experimental Free Energy Distributions: ..."
Shunzhou Wan et al. (2022)
- Shunzhou Wan
, Agastya P. Bhati
, David W. Wright
, Ian D. Wall, Alan P. Graves, Darren V. S. Green, Peter V. Coveney
:
Ensemble Simulations and Experimental Free Energy Distributions: Evaluation and Characterization of Isoxazole Amides as SMYD3 Inhibitors. J. Chem. Inf. Model. 62(10): 2561-2570 (2022)
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