Now showing items 1-3 of 3

    • Classification of crystallization outcomes using deep convolutional neural networks. 

      Bruno, Andrew E; Charbonneau, Patrick; Newman, Janet; Snell, Edward H; So, David R; Vanhoucke, Vincent; Watkins, Christopher J; ... (9 authors) (PloS one, 2018-01)
      The Machine Recognition of Crystallization Outcomes (MARCO) initiative has assembled roughly half a million annotated images of macromolecular crystallization experiments from various sources and setups. Here, state-of-the-art ...
    • Computational crystallization. 

      Altan, Irem; Charbonneau, Patrick; Snell, Edward H (Arch Biochem Biophys, 2016-07-15)
      Crystallization is a key step in macromolecular structure determination by crystallography. While a robust theoretical treatment of the process is available, due to the complexity of the system, the experimental process ...
    • Statistical analysis of crystallization database links protein physico-chemical features with crystallization mechanisms. 

      Fusco, Diana; Barnum, Timothy J; Bruno, Andrew E; Luft, Joseph R; Snell, Edward H; Mukherjee, Sayan; Charbonneau, Patrick (PLoS One, 2014)
      X-ray crystallography is the predominant method for obtaining atomic-scale information about biological macromolecules. Despite the success of the technique, obtaining well diffracting crystals still critically limits going ...