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Audrey G. Fikes

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2026

Open-Sourced In Silico Drug Screening.

This chapter describes a structure-based computational approach to perform high-throughput ligand screens of chemical libraries using open-source software programs and illustrates this workflow with the enzymatic molecular target NAD(P)H:quinone oxidoreductase1 (NQO1), which is overexpressed in a number of human solid tumors.

Audrey G. Fikes, Melissa C. Srougi · 0 citations