refineD: improved protein structure refinement using machine learning based restrained relaxation.

Journal: Bioinformatics (Oxford, England)
Published Date:

Abstract

MOTIVATION: Protein structure refinement aims to bring moderately accurate template-based protein models closer to the native state through conformational sampling. However, guiding the sampling towards the native state by effectively using restraints remains a major issue in structure refinement.

Authors

  • Debswapna Bhattacharya
    Department of Electrical Engineering and Computer Science, Wichita State University, Wichita, KS, 67260, USA.