forthcoming articles

The following articles are a selection of those recently accepted for publication in Acta Crystallographica Section A: Foundations and Advances.

See also Forthcoming articles in all IUCr journals.

Accepted 7 August 2017

About difference electron densities and their properties

the most popular difference syntheses have been characterized and a new difference synthesis has been proposed.

Accepted 4 August 2017

Real-time detection and resolution of atom bumping in crystallographic models

Presented here is an O(n{\rm log}n) algorithm that detects atom bonding in a unit cell. As an application of this algorithm, an evaluation function for atom bumping is proposed, which can be used for real-time elimination of crystallographic models with unreasonable bond lengths during the procedure of crystal structure determination in the direct space.


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