Binding of D- and L-captopril inhibitors to metallo–lactamase studied by polarizable molecular mechanics and quantum mechanics. - Jens Antony; Nohad Gresh; Lars Olsen; Lars Hemmingsen; Christopher J. Schofield; Rogert Bauer (J. Comput. Chem., 2002)

Epimerization and desaturation by carbapenem synthase (CarC). A hybrid DFT study. - Tomasz Borowski; Ewa Broclawik; Christopher J. Schofield; Per E. M. Siegbahn (J. Comput. Chem., 2006)

Hypoxia-dependent sequestration of an oxygen sensor by a widespread structural motif can shape the hypoxic response - a predictive kinetic model. - Bernhard Schmierer; Béla Novák; Christopher J. Schofield (BMC Syst. Biol., 2010)

MeLAD: an integrated resource for metalloenzyme-ligand associations. - Gen Li; Yu Su; Yuhang Yan; Jiayi Peng; Qing-Qing Dai; Xiang-Li Ning; Cheng-Long Zhu; Chen Fu; Michael A. McDonough; Christopher J. Schofield; Cheng Huang 003; Guo-Bo Li (Bioinform., 2020)

Accelerating Inhibitor Discovery for Multiple SARS-CoV-2 Targets with a Single, Sequence-Guided Deep Generative Framework. - Vijil Chenthamarakshan; Samuel C. Hoffman; C. David Owen; Petra Lukacik; Claire Strain-Damerell; Daren Fearon; Tika R. Malla; Anthony Tumber; Christopher J. Schofield; Helen M. E. Duyvesteyn; Wanwisa Dejnirattisai; Loic Carrique; et al. (CoRR, 2022)

MeDBA: the Metalloenzyme Data Bank and Analysis platform. - Jun-Lin Yu; Song Wu; Cong Zhou; Qing-Qing Dai; Christopher J. Schofield; Guo-Bo Li (Nucleic Acids Res., 2023)