DL/SCI/R16
REFINEMENT OF PROTEIN STRUCTURES
November, 1980
Foreword |
(v) |
Practical aspects of stereochemically restrained refinement of protein structures. by Wayne A. Hendrickson |
1 |
Weighting in the restrained least squares refinement of protein structures. by D.S. Moss |
9 |
Use of CORELS for the refinement of biological macromolecules. by Joel L. Sussman |
13 |
New results on fast Fourier least-squares refinement technique. by R.C. Agarwal |
24 |
Block diagonal least squares refinement using fast Fourier techniques. by E.J. Dodson |
29 |
Refinement experiences using chain constraints in real space and energy restraints in reciprocal spaces. by Wolfgang Steigemann |
40 |
On the relationship between X-ray and energy refinement. by R. Diamond |
47 |
Summary of the main discussion period. by A.C. Bloomer and P.R. Evans |
51 |
Modelling disordered parts of protein crystals: a possible aid in crystallographic refinement. by Jan Hermans |
54 |
A novel technique to improve the quality of an electron-density map. by T.N. Bhat and D.M. Blow |
62 |
Phase extension and refinement at 1.37 Å resolution of Avian pancreatic polypeptide using a modified tangent formula. by I.J. Tickle |
64 |
Results and computational aspects of refinement on the CRAY-1. by W. Pulford |
69 |
The importance of refined structures to the understanding of enzyme action. by A.R. Sielecki and M.N.G. James |
78 |
Map improvement by the combination of partial structure and isomorphous phase information. by D.W. Rice |
88 |
Some refinement experiences with 2Zn insulin. by Guy Dodson |
95 |
Summary of the general discussion periods. by John W. Campbell and Mike Elder |
99 |