Computational redesign of bacterial biotin carboxylase inhibitors using structure-based virtual screening of combinatorial libraries

HIGHLIGHTS

• who: Michal Brylinski and Grover L. Waldrop from the Division of Biochemistry and Molecular Biology, Louisiana State University, Baton Rouge, Center for Computation and Technology, Louisiana State University, Baton Rouge, LA, USA have published the research: Computational Redesign of Bacterial Biotin Carboxylase Inhibitors Using Structure-Based Virtual Screening of Combinatorial Libraries, in the Journal: Molecules 2014, 19, 4021-4045 of 21/02/2014
• what: The aim of this study is to identify low molecular weight fragments that could be coupled to the amino-oxazole scaffold and enable the molecule to bind to BC from both . . .
  

   

  

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