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RELAXFIT
A program for extracting relaxation rates (e.g. R1 or
R2) from fitting experimental data to an exponentially decaying function.
Reference: Fushman et al., J. Mol. Biol. 266 (1997) 173.
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zip
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tar.gz
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DYNAMICS
A program for model-free analysis of 15N relaxation data.
Features isotropic, axially-symmetric and fully anisotropic models for the overall
tumbling of the molecule, and monomer-dimer equilibration.
Reference: Fushman et al., J. Mol. Biol. 266 (1997) 173; Hall & Fushman, J. Biomol. NMR (2003) 27, 261.
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zip
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tar.gz
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ROTDIF
A program for the determination of the overall rotational diffusion tensor of a molecule from spin-relaxation data.
Features isotropic, axially-symmetric, and fully anisotropic models for the overall motion.
Reference: Fushman et al., Biochemistry 38 (1999) 10225-10230; Varadan et al., JMB 324 (2002) 637; Walker et al. J. Magn. Reson. (2004) 168, 336; Fushman et al, Progress NMR Spectroscopy, (2004) 44, 189.
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for Matlab 6.5 and older versions
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for Matlab 7 and newer versions
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JCSA
A program for the determination of the spectral
densities, J(w), and the 15N chemical shift anisotropy from the field dependence
of 15N relaxation rates, R2, R1, and NOE. Requires relaxation data measured at 2
or more fields.
Features various methods of analysis, including independent assessment of the conformational exchange term, Rex.
Reference: Fushman et al., J. Amer. Chem. Soc. 121 (1999) 8577-8582.
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zip
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tar.gz
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ETAFIT
A program for the determination of the magnitude and
orientation of the 15N chemical shift anisotropy from the field
dependence of the ratio, h /R2, of the CSA/dipolar
cross-correlation term h and the 15N
transverse relaxation rate R2. Requires relaxation data measured at 2 or more
fields.
Reference: Fushman et al., J. Amer. Chem. Soc. 120 (1998) 10947-10952.
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zip
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tar.gz
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PICK
A program for automatic peak picking in a 2D spectrum
given a reference peak list.
Features reading-in spectra produced with XWINNMR and full peak-list
export/importability with XEASY.
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zip
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tar.gz
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