OLEX2 : a complete structure solution, refinement and analysis program
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Abstract
New software, OLEX2 , has been developed for the determination, visualization and analysis of molecular crystal structures. The software has a portable mouse-driven workflow-oriented and fully comprehensive graphical user interface for structure solution, refinement and report generation, as well as novel tools for structure analysis. OLEX2 seamlessly links all aspects of the structure solution, refinement and publication process and presents them in a single workflow-driven package, with the ultimate goal of producing an application which will be useful to both chemists and crystallographers.
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5Topics & keywords
Topics
Keywords
- Workflow
- Computer science
- Visualization
- Software
- Computational science
- Graphical user interface
- Interface (matter)
- Process (computing)
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