Why is there a difference between the Rfactors from Refmac and Sfcheck?: Difference between revisions
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(New page: Sfcheck usually does not have enough information to reproduce your full refinement. In particular, it does not reproduce the solvent model, TLS refinement, anomalous terms, variant scatte...) |
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Sfcheck usually does not have enough information to reproduce your full refinement. In particular, it does not reproduce the solvent model, TLS refinement, anomalous terms, variant scattering factors, etc. So it cannot reproduce your original Fcalc values. Given that it has different Fcalc, it is no wonder that it also has different R values. | Sfcheck usually does not have enough information to reproduce your full refinement. In particular, it does not reproduce the solvent model, TLS refinement, anomalous terms, variant scattering factors, etc. So it cannot reproduce your original Fcalc values. Given that it has different Fcalc, it is no wonder that it also has different R values. | ||
Latest revision as of 22:17, 19 November 2008
Sfcheck usually does not have enough information to reproduce your full refinement. In particular, it does not reproduce the solvent model, TLS refinement, anomalous terms, variant scattering factors, etc. So it cannot reproduce your original Fcalc values. Given that it has different Fcalc, it is no wonder that it also has different R values.