AnalysisStructure

AnalysisStructure provides tools to assist with the structure calculation stage of biomolecular NMR projects. Still at the alpha-release stage, we are in the process of testing our first features with users. Once fully developed, this part of the program will include integrated setup of structure calculations for multiple structure calculation programs, import of results including quality scores, accurate violation analysis, links to structure viewers, integrated access to structure validation programs, flexible graph generation and more.

Screen capture showing the NEF import/export process

NEF import/export

We are actively working with the developers of XPLOR-NIH, ARIA and CYANA to ensure that we can seamlessly import and export data to these programs. We are doing this via the new NMR Exchange Format (NEF) which allows accurate exchange of a wide range of information.

Screen capture showing how you can view in PyMol

Link to PyMol

Automatically view your restraints on a structure in PyMol.

AnalysisStructure screen capture showing violation and restraint tables

Restraint and Violation Analysis

Use our Violation and Restraint tables to link directly to associated peaks and compare violations from different calculations.

Download AnalysisStructure

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