State of the Toolbox: an overview of the Computational Crystallography Toolbox (CCTBX)
Fast triplet generator for direct methods
Gallery of direct-space asymmetric units
Reduced cell computations
Determination of lattice symmetry
N-Gaussian approximations to scattering factors
Fast structure-factor gradients
Universal reflection file reader
Geometry restraints
Bulk solvent correction and scaling
Phil and friends (latest Phil documentation)
Refinement tools
Reflection statistics
Double coset decomposition
iotbx.mtz
See also Sienna 2005 tutorials
iotbx.pdb
mmtbx.alignment
scitbx.math.superpose
mmtbx.super
Refinement tools for small-molecule crystallographers Phil developments (latest Phil documentation)
Symmetry in crystallographic applications
Experience converting a large Fortran-77 program to C++