CYANA Macro: talos: Difference between revisions
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== Description == | == Description == | ||
Determines φ/ψ angle restraints by running the external program TALOS+ (Shen et al., J. Biomol. NMR 44, 213-223 | Determines φ/ψ angle restraints by running the external program TALOS+ (Shen et al., J. Biomol. NMR 44, 213-223, 2009). TALOS+ is an external program that must be installed and set up independently from CYANA. TALOS+ will be called with the command given by the '''talos''' parameter. Chemical shifts must have been read previously. The angle restraints overwrite any angle restraints in memory unless the '''append''' option is given. | ||
== Example == | == Example == | ||
Latest revision as of 12:24, 1 August 2011
Run the external program TALOS+
Parameters
- talos=string
- (default: talos+)
- append
Description
Determines φ/ψ angle restraints by running the external program TALOS+ (Shen et al., J. Biomol. NMR 44, 213-223, 2009). TALOS+ is an external program that must be installed and set up independently from CYANA. TALOS+ will be called with the command given by the talos parameter. Chemical shifts must have been read previously. The angle restraints overwrite any angle restraints in memory unless the append option is given.
Example
The typical application is:
read prot all.prot talos write aco talos.aco