er Diffraction Data Crystal-GA: A Program for Crystal Structure Determination via X-ray Powder Diffraction DataCrystal-GA: A Program for Crystal Structure Determination via X-ray Powder Diffraction DataHadi D. Arman
DASH: a program for crystal structure determination from powder diffraction data DASH is a user-friendly graphical-user-interface-driven computer program for solving crystal structures from X-ray powder diffraction data, optimized for m... K Shankland,E Pidcock,JVD Streek,... - 《Journal of ...
PeckCryst : a program for structure determination from powder diffraction data using a particle swarm optimization algorithmPeckCrystparticle swarm optimizationcomputer programspowder diffractionPeckCryst has been developed for the solution of molecular crystal structures from powder diffraction data using a ...
This module allows for crystal structure determination from indexed and un-indexed powder diagrams. It is implemented with a new similarity index for automated comparison of powder diagrams which is valid for refinement even in cases of large deviations in the cell constants and overlapping picks. As...
M. (1976)Shelx76.Program for Crystal Structure Determination (Univ. of Cambridge, England). Tiekink, E. R. T. (1987)Acta Crystallogr... AM Hounslow,ERT Tiekink - 《Journal of Crystallographic & Spectroscopic Research》 被引量: 41发表: 1991年 Experimental and Theoretical Charge Density Analy...
This paper describes a powerful preliminary to various least-squares programs for finding the exact crystal orientation for the oscillation method. It is well suited to cases of large initial misorientation. It uses the real-time rotation and clipping capabilities of the high-performance graphics syste...
calibrate/ - Tools for calibration camera/ - Camera interaction code config/ - Configuration management experiments/ - Specific data collection routines formats/ - Image formats and other IO gui/ - GUI code microscope/ - Microscope interaction code neural_network/ - Crystal quality prediction processin...
New software, OLEX2 , has been developed for the determination, visualization and analysis of molecular crystal structures. The software has a portable mouse-driven workflow-oriented and fully comprehensive graphical user interface for structure solution, refinement and report generation, as well as nove...
3D protein structure determinationC programconvergence propertiesAPA is a computer program, written in C, designed to determine the three-dimensional structure of proteins using distance geometry. We present the sampling and convergence properties of APA, as tested on bovine pancreatic trypsin inhibitor ...
Maximum entropy approach to the determination of solution conformation of flexible polypeptides by global conformational analysis and NMR spectroscopy--app... A method is proposed to determine the conformational equilibrium of flexible polypeptides in solution, using the data provided by NMR spectroscopy an...