Accession Number:

ADA126171

Title:

Restrained Least-Squares Program (RESLSQ) Users Manual.

Descriptive Note:

Memorandum rept.,

Corporate Author:

NAVAL RESEARCH LAB WASHINGTON DC

Report Date:

1983-03-28

Pagination or Media Count:

63.0

Abstract:

A restrained least-squares program package is available for analysis of x-ray diffraction data from small and medium sized molecules. The package consists of three basic programs. The first, SCATT, prepares a binary data file which contains scattering factor information for each reflection. The second, MODEL, constructs the ideal molecule towards which the experimental model is refined. The third, RESLSQ, performs the least-squares refinement using conjugant gradient sparse-matrix methods. Author

Subject Categories:

  • Statistics and Probability
  • Computer Programming and Software
  • Optics

Distribution Statement:

APPROVED FOR PUBLIC RELEASE