Abstract
We highlight the fact that the rotation matrix minimizing the root-mean-square deviation between two molecular conformations [W. Kabsch, Acta Cryst. A32, 922 (1976)] also satisfies the Eckart axis conditions [C. Eckart, Phys. Rev. 47, 552 (1935)].
| Original language | English |
|---|---|
| Article number | 224105 |
| Journal | Journal of Chemical Physics |
| Volume | 122 |
| Issue number | 22 |
| DOIs | |
| State | Published - Jun 8 2005 |
ASJC Scopus subject areas
- General Physics and Astronomy
- Physical and Theoretical Chemistry
Fingerprint
Dive into the research topics of 'Eckart axis conditions and the minimization of the root-mean-square deviation: Two closely related problems'. Together they form a unique fingerprint.Cite this
- APA
- Author
- BIBTEX
- Harvard
- Standard
- RIS
- Vancouver