One of the key parts of the crystal structure solution process from powder diffraction data is the determination of the lattice parameters from experimental data shortly called indexing. The successive dichotomy method is one of the most common ones for this process because it allows an exhaustive search. In this paper, we discuss several improvements for this indexing method that significantly reduces the search space and decrease the solution time. We also propose a combination of this method with other indexing methods: grid search and TREOR. The effectiveness and time-consumption of such algorithm were tested on several datasets, including orthorhombic, monoclinic, and triclinic examples. Finally, we discuss the impacts of the proposed ...
The indexing methods currently used for serial femtosecond crystallography were originally developed...
Many solids can be prepared only as microcrystalline powders and are not suitable for structural cha...
From the values of sin2θ taken from powder photographs of the cubic crystal system, a variable ...
Serial crystallography records still diffraction patterns from single, randomly oriented crystals, t...
Serial crystallography data can be challenging to index, as each frame is processed individually, ra...
A method for the determination of crystal structures from powder diffraction data is presented that ...
We present improved methods for indexing diffraction patterns from macromolecular crystals. The nove...
The development of a crystal indexing computer program using interplanar angles and lattice spacings...
A crystallographic indexing algorithm,pinkIndexer, is presented for the analysisof snapshot diffract...
An artificial neural network, in combination with local optimization, is shown to be an effective ap...
A novel algorithm for indexing multiple crystals in snapshot X-ray diffraction images, especially su...
Two multisample laboratory powder diffractometers have been evaluated for the purpose of pattern ind...
ABSTRACT: Two multisample laboratory powder diffractometers have been evaluated for the purpose of p...
Recent developments of two-color operation modes at X-ray free-electron laser facilities provide new...
The ICDD is in the midst of an exciting transition to relational database formats for the Powder Dif...
The indexing methods currently used for serial femtosecond crystallography were originally developed...
Many solids can be prepared only as microcrystalline powders and are not suitable for structural cha...
From the values of sin2θ taken from powder photographs of the cubic crystal system, a variable ...
Serial crystallography records still diffraction patterns from single, randomly oriented crystals, t...
Serial crystallography data can be challenging to index, as each frame is processed individually, ra...
A method for the determination of crystal structures from powder diffraction data is presented that ...
We present improved methods for indexing diffraction patterns from macromolecular crystals. The nove...
The development of a crystal indexing computer program using interplanar angles and lattice spacings...
A crystallographic indexing algorithm,pinkIndexer, is presented for the analysisof snapshot diffract...
An artificial neural network, in combination with local optimization, is shown to be an effective ap...
A novel algorithm for indexing multiple crystals in snapshot X-ray diffraction images, especially su...
Two multisample laboratory powder diffractometers have been evaluated for the purpose of pattern ind...
ABSTRACT: Two multisample laboratory powder diffractometers have been evaluated for the purpose of p...
Recent developments of two-color operation modes at X-ray free-electron laser facilities provide new...
The ICDD is in the midst of an exciting transition to relational database formats for the Powder Dif...
The indexing methods currently used for serial femtosecond crystallography were originally developed...
Many solids can be prepared only as microcrystalline powders and are not suitable for structural cha...
From the values of sin2θ taken from powder photographs of the cubic crystal system, a variable ...