Synthesis of malarial plasmepsin inhibitors and prediction of binding modes by molecular dynamics simulations.

Ersmark, K; Nervall, M; Hamelink, E; Janka, LK; Clemente, JC; Dunn, BM; Blackman, MJ; Samuelsson, B; Aqvist, J; Hallberg, A; (2005) Synthesis of malarial plasmepsin inhibitors and prediction of binding modes by molecular dynamics simulations. Journal of medicinal chemistry, 48 (19). pp. 6090-106. ISSN 0022-2623 DOI: https://doi.org/10.1021/jm050463l

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