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Quantitative classification of covalent and noncovalent H-bonds.
J Phys Chem B. 2006 Apr 6;110(13):6444-6. doi: 10.1021/jp0600817.
J Phys Chem B. 2006.
PMID: 16570938
Origins of the activity of PAL and LAP enzyme inhibitors: toward ab initio binding affinity prediction.
Dyguda E, Grembecka J, Sokalski WA, Leszczyński J.
Dyguda E, et al.
J Am Chem Soc. 2005 Feb 16;127(6):1658-9. doi: 10.1021/ja042691v.
J Am Chem Soc. 2005.
PMID: 15700998
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