title: Application of a neural network in high-throughput protein crystallography.
abstract: High-throughput protein crystallography requires the automation of multiple steps used in the protein structure determination. One crucial step is to find and monitor the crystal quality on the basis of its diffraction pattern. It is often time-consuming to scan protein crystals when selecting a good candidate for exposure. The use of neural networks for this purpose is explored. A dynamic neural network algorithm to achieve a fast convergence and high-speed image recognition has been developed. On the test set a 96% success rate in identifying properly the quality of the crystal has been achieved.
authors.affiliation: Brookhaven National Laboratory, Upton, NY 11973, USA.
authors.forename: A
authors.initials: A
authors.lastname: Berntson
authors.forename: V
authors.initials: V
authors.lastname: Stojanoff
authors.forename: H
authors.initials: H
authors.lastname: Takai
mesh_terms: D000465:Algorithms; D003461:Crystallography / Q000379:methods*; D016571:Neural Networks, Computer; D011506:Proteins / Q000737:chemistry* / Q000145:classification*; D012371:Robotics / Q000379:methods*; D014961:X-Ray Diffraction / Q000379:methods
chemical_list: D011506:Proteins