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e.g. via 'View Files from Job' menu. Not clear how best to implement this: ... Liz Potterton planning to look at reusing Wendy's database handler code for this ...
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Suite of programs for automated structure solution based on the CCP4i infrastructure. Developed by Steven ... Windows drives can also be browsed (e.g. C: or D: ...
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watch for announcements when update becomes available. 23rd August 2005 ... topdraw - sketchpad for drawing protein topology cartoons (see right) ...
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'To fill the need for project tracking within the BIOXHIT structure solution software pipeline' ... Talk to other projects for possible links/requirements ...
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... system that address the needs both of automated software pipelines, and manual ... The Collaborative Computational Project No 4 (CCP4) is a UK-based software ...
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Data collection, data processing and scaling (1) relationship of Mosflm to CCP4 ... when viewed with the CCP4 graph viewer LOGGRAPH, as it contains graphs of ...
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REFMAC5 is a program for the refinement of macromolecular structures. ... [Schomaker & Trueblood (1968) On the rigid-body motion of molecules in. crystals Acta Cryst. ...
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Acknowledgements Fei Long, Alexei Vagin, Paul Young, Andrey Lebedev, Garib Murshudov Balbes and Refmac Martyn Winn, MrBUMP Airlie McCoy, Randy Read ...
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A Molecular Replacement Pipeline Garib Murshudov Chemistry Department, University of York Contents Introduction Organisation of BALBES Search model preparation ...
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Please come and visit for software demos, questions, freebies ... Please fill in and return the questionnaires in the CCP4 packs ...
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Macromolecular Powder Diffraction: Jennifer Doebbler. and. Robert Von Dreele ... Overlaps hurt. Goal: best. false' minima. Omit Map ...
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Refinement of Macromolecular structures using REFMAC5. Garib N Murshudov ... TNT. BUSTER/TNT. Phenix.refine. RESTRAINT. MOPRO. Considerations in refinement ...
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Every atom's diffracting power is further reduced at higher ... all atoms in the unit cell relative to the origin. The name of the software we will use for ...
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... positional parameters such that they are not allowed to deviate as much (from ... The RMS deviations from ideal values are a bit misleading, since you use them to ...
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An automation framework for Molecular Replacement. ... The resulting models from molecular replacement are passed to Refmac for restrained refinement. ...
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... after molecular replacement or when refining against data from isomorphous crystals TLS - at medium and end stages of refinement at resolutions up to 1.7-1.6A ...
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... handler dbCCP4i is a small server program that handles interactions between the ... much more complexity in these automated systems whilst making the outcome much ...
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CCLRC Daresbury Laboratory, Warrington, Cheshire WA4 4AD, UK ... also like to thank the many people who have contributed to the project since its inception. ...
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... complementarity between influzena virus tern N9 neuraminidase (right) and the ... The interface is shown opened out in book-like fashion, with Sc values coloured ...
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