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Effect of Microenvironment on the Geometrical Structure of d(A)5 d(T)5 and d(G)5 d(C)5 DNA Mini-Helixes and the Dickerson Dodecamer: A Density Functional Theory Study.
J Phys Chem B. 2020 Oct 22;124(42):9343-9353. doi: 10.1021/acs.jpcb.0c06154. Epub 2020 Oct 13.
J Phys Chem B. 2020.
PMID: 32975118
Diffusion of energetic compounds through biological membrane: Application of classical MD and COSMOmic approximations.
Golius A, Gorb L, Isayev O, Leszczynski J.
Golius A, et al.
J Biomol Struct Dyn. 2019 Jan;37(1):247-255. doi: 10.1080/07391102.2018.1424037. Epub 2018 Jan 19.
J Biomol Struct Dyn. 2019.
PMID: 29301457
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Experimental and computational study of membrane affinity for selected energetic compounds.
Golius A, Gorb L, Michalkova Scott A, Hill FC, Shukla M, Goins AB, Johnson DR, Leszczynski J.
Golius A, et al.
Chemosphere. 2016 Apr;148:322-7. doi: 10.1016/j.chemosphere.2016.01.010. Epub 2016 Jan 25.
Chemosphere. 2016.
PMID: 26820779
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QSAR analysis of the toxicity of nitroaromatics in Tetrahymena pyriformis: structural factors and possible modes of action.
Artemenko AG, Muratov EN, Kuz'min VE, Muratov NN, Varlamova EV, Kuz'mina AV, Gorb LG, Golius A, Hill FC, Leszczynski J, Tropsha A.
Artemenko AG, et al. Among authors: golius a.
SAR QSAR Environ Res. 2011 Jul-Sep;22(5-6):575-601. doi: 10.1080/1062936X.2011.569950. Epub 2011 Jun 30.
SAR QSAR Environ Res. 2011.
PMID: 21714735
Free PMC article.
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