Terrence E. O’Brien

AI is a viable alternative to high throughput screening: a 318-target study

Izhar Wallach, Denzil Bernard, Kong T. Nguyen et al. · Scientific Reports · 2024 · 120 citations · Full text

Pharmacy, Bioinformatics, Medicinal Chemistry +16

Comparison of Small Molecule Inhibitors of the Bacterial Cell Division Protein FtsZ and Identification of a Reliable Cross-Species Inhibitor

David E. Anderson, Michelle B. Kim, Jared T. Moore et al. · ACS Chemical Biology · 2012 · 80 citations

Life Sciences, Biochemistry, Molecular Biology +12

Mechanistically informed predictions of binding modes for carbocation intermediates of a sesquiterpene synthase reaction

Terrence E. O’Brien, Steve J. Bertolani, Dean J. Tantillo et al. · Chemical Science · 2016 · 58 citations · Full text

Pharmacy, Biochemistry, Molecular Biology +17

Predicting Productive Binding Modes for Substrates and Carbocation Intermediates in Terpene Synthases—Bornyl Diphosphate Synthase As a Representative Case

Terrence E. O’Brien, Steven J. Bertolani, Yue Zhang et al. · ACS Catalysis · 2018 · 52 citations

Pharmacy, Biochemistry, Chemistry +17

Synthesis and Evaluation of Quinazolines as Inhibitors of the Bacterial Cell Division Protein FtsZ

Gabriella M. Nepomuceno, Katie M. Chan, Valerie Huynh et al. · ACS Medicinal Chemistry Letters · 2015 · 39 citations · Full text

Life Sciences, Biochemistry, Microbiology +13