INFIT: Difference between revisions
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== References == | == References == | ||
* Szyperski, T., Güntert, P., Otting, G. & Wüthrich, K. Determination of scalar coupling constants by inverse Fourier transformation of in-phase multiplets. [http://dx.doi.org/10.1016/0022-2364(92)90209-P J. Magn. Reson. 99, 552– 560 (1992)] | * Szyperski, T., Güntert, P., Otting, G. & Wüthrich, K. Determination of scalar coupling constants by inverse Fourier transformation of in-phase multiplets. [http://dx.doi.org/10.1016/0022-2364(92)90209-P J. Magn. Reson. 99, 552– 560 (1992)] | ||
Revision as of 14:39, 15 June 2009
Coupling constants from inverse Fourier transformation of in-phase multiplets
INFIT (© by Peter Güntert) is a program to determine scalar coupling constants from in-phase multiplets. The scalar coupling constants are extracted from the in-phase multiplets by inverse Fourier transformation of the data points representing one or several cross peaks and a non-linear least-squares fitting procedure.
Availability
- INFIT is available free-of-charge. The current version is INFIT 2.0.
References
- Szyperski, T., Güntert, P., Otting, G. & Wüthrich, K. Determination of scalar coupling constants by inverse Fourier transformation of in-phase multiplets. J. Magn. Reson. 99, 552– 560 (1992)