CCTBX

The SourceForge cctbx project currently contains these modules. The core libraries required for most other applications are libtbx, boost_adaptbx, scitbx, cctbx, and usually iotbx. Functionality specific to macromolecules and small molecules lives in mmtbx and smtbx, respectively... The build system common to all other modules. This includes a very thin wrapper around the SCons software construction tool. It also contains many useful frameworks and utilities to simplify application development, including tools for regression testing, parallelization across multiprocessor systems and managed clusters, and a flexible, modular configuration syntax called PHIL (Python Hierarchial Interface Language) used throughout the CCTBX... Libraries for general scientific computing (i.e. libraries that are not specific to crystallographic applications). This includes a family of high-level C++ array types, a fast Fourier transform library, and a C++ port of the popular L-BFGS quasi-Newton minimizer,..