NMR Refine/Advanced expands the refinement capabilities found in NMR Refine/DG-II to include simulated annealing and restrained molecular mechanics and dynamics (MD Schedule), refinement of NOE intensities using hybrid-matrix approaches (IRMA), direct refinement of NOE volumes (NOE-MD), an interface to back-calculating 2D NOESY crosspeak intensities (NOE Simulate), and a spreadsheet method of analyzing NMR-related structural and dynamical molecular parameters (Query).
Christine Sheppard
Director of Marketing
Molecular Simulations
9685 Scranton Road
San Diego, CA 92121-2777
USA
619-458-9990
619-458-0136 (fax)
cxs@biosym.com
For applications in related solution areas, see the following indices: Computational Chemistry, Molecular Modeling, Simulation, Visual Simulation, Visualization, the developer index for Molecular Simulations and the market segment index for Chemistry, Biochem, Biotech, Materials.
