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      The use of haptic interfaces and web services in crystallography: an application for a `screen to beam' interface

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      Journal of Applied Crystallography
      International Union of Crystallography (IUCr)

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          Abstract

          Haptic interfaces have become common in consumer electronics. They enable easy interaction and information entry without the use of a mouse or keyboard. The work presented here illustrates the application of a haptic interface to crystallization screening in order to provide a natural means for visualizing and selecting results. By linking this to a cloud-based database and web-based application program interface, the same application shifts the approach from `point and click' to `touch and share', where results can be selected, annotated and discussed collaboratively. In the crystallographic application, given a suitable crystallization plate, beamline and robotic end effector, the resulting information can be used to close the loop between screening and X-ray analysis, allowing a direct and efficient `screen to beam' approach. The application is not limited to the area of crystallization screening; `touch and share' can be used by any information-rich scientific analysis and geographically distributed collaboration.

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          A deliberate approach to screening for initial crystallization conditions of biological macromolecules.

          A method to rationally predict crystallization conditions for a previously uncrystallized macromolecule has not yet been developed. One way around this problem is to determine initial crystallization conditions by casting a wide net, surveying a large number of chemical and physical conditions to locate crystallization leads. A facility that executes the rapid survey of crystallization lead conditions is described in detail. Results and guidelines for the initial screening of crystallization conditions, applicable to both manual and robotic setups, are discussed.
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            Is Open Access

            In situ macromolecular crystallography using microbeams

            A sample environment for mounting crystallization trays has been developed on the microfocus beamline I24 at Diamond Light Source. The technical developments and several case studies are described.
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              SLS Crystallization Platform at Beamline X06DA—A Fully Automated Pipeline Enablingin SituX-ray Diffraction Screening

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                Author and article information

                Journal
                JACGAR
                Journal of Applied Crystallography
                J Appl Crystallogr
                International Union of Crystallography (IUCr)
                1600-5767
                December 2016
                November 11 2016
                : 49
                : 6
                : 2082-2090
                Article
                10.1107/S160057671601431X
                8944b1c8-85dd-446d-a186-207c486ca150
                © 2016

                http://journals.iucr.org/services/copyrightpolicy.html

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