Significant time and effort are often required to solve and complete a macromolecular crystal
structure. The development of automated computational methods for the analysis, solution …

X-ray crystallography is a critical tool in the study of biological systems. It is able to provide
information that has been a prerequisite to understanding the fundamentals of life. It is also a …

Macromolecular crystallographic refinement has recently been made more efficient by the
use of cross-validated maximum likelihood targets and torsion-angle molecular dynamics …

CRANK is a novel suite for automated macromolecular structure solution and uses recently
developed programs for substructure detection, refinement, and phasing. CRANK utilizes …

Advances in our understanding of macromolecular structure come from experimental
methods, such as X-ray crystallography, and also computational analysis of the growing …

The PHENIX AutoBuild wizard is a highly automated tool for iterative model building,
structure refinement and density modification using RESOLVE model building, RESOLVE …

Since the ratio of the number of observations to adjustable parameters is small at low
resolution, it is necessary to use complementary information for the analysis of such data …

The combination of algorithms from the structure-modeling field with those of
crystallographic structure determination can broaden the range of templates that are useful …

With currently more than 126 000 publicly available structures and an increasing growth
rate, the Protein Data Bank constitutes a rich data source for structure-driven research in …

During the last two decades, the number of sequence-known proteins has increased rapidly.
In contrast, the corresponding increment for structure-known proteins is much slower. The …