DFT Chemical Reactivity Driven by Biological Activity: Applications for the Toxicological Fate of Chlorinated PAHs

Author:

Putz Mihai V.,Putz Ana-Maria

Publisher

Springer Berlin Heidelberg

Reference230 articles.

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4. Cherkasov A (2005) Curr Comp Aided Drug Des 1:21–42

5. OECD (2007) OECD (Organization for Economic Co-operation and Development): Guidance document [ENV/JM/MONO(2007)2] on the validation of (Quantitative) structure–activity relationship [(Q)SAR] models. OECD Environment Health and Safety Publications (2007) Series on Testing and Assessment, No. 69, Paris

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