Improve isotropic sampling directions for backbone

ExcitedStates / qfit-3.0

qFit: Automated and unbiased multi-conformer models from X-ray and EM maps.

MIT License

31 stars 11 forks source link

Closed stephaniewankowicz closed 5 months ago

stephaniewankowicz commented 12 months ago

We currently sample backbone by following cartesian directions. We should instead be sampling in the direction of Cβ-Cα, C-N, and (Cβ-Cα × C-N).

stephaniewankowicz commented 8 months ago

Test

stephaniewankowicz commented 5 months ago

This is completed.