python3-cctbx 2022.9+ds2+~3.11.2+ds1-6build1 (amd64 binary) in ubuntu lunar
Computational Crystallography Toolbox contains following modules:
- annlib_adaptbx:
- boost_adaptbx: wrappers for Boost functionality in CCTBX
- cbflib_adaptbx:
- ccp4io_adaptbx:
- cctbx: Libraries for general crystallographic applications,
useful for both small-molecule and macro-molecular
- cma_es:
- crys3d: Modules for the display of molecules, electron density,
and reciprocal space data.
- dxtbx: The Diffraction Image Toolbox, a library for handling
X-ray detector data of arbitrary complexity from a variety
of standard formats.
- fable: Fortran EMulation library for porting Fortran77 to C++.
- gltbx: Python bindings for OpenGL
- iotbx: Working with common crystallographic file formats.
- libtbx: 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
and a flexible, modular configuration syntax called PHIL
- mmtbx: Functionality specific to macromolecular crystallography.
This includes all of the machinery required for setup of
in phenix.refine. The majority of infrastructure for the MolProbity
- omptbx: OpenMP interface.
- rstbx: A reciprocal space toolbox to autoindex small molecule Bragg
- scitbx: General scientific calculations. his 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.
- smtbx: Small-Molecule crystallography.
- spotfinder:
- tbxx:
- wxtbx: wxPython controls used in the Phenix GUI and various
utilities
.
This package provide a selected collection of python modules from the cctbx project.
Details
- Package version:
- 2022.9+ds2+~3.11.2+ds1-6build1
- Status:
- Published
- Component:
- universe
- Priority:
- Optional
Downloadable files
Package relationships
- Depends on:
- ca-certificates
- libantlr3c-3.4-0
- libboost-numpy1.74.0 (>= 1.74.0)
- libboost-numpy1.74.0-py311
- libboost-python1.74.0 (>= 1.74.0)
- libboost-python1.74.0-py311
- libboost-thread1.74.0 (>= 1.74.0)
- libc6 (>= 2.34)
- libcbf1 (>= 0.9.7+dfsg1-2~)
- libccp4c0 (>= 8.0.0)
- libcctbx-dev (= 2022.9+ds2+~3.11.2+ds1-6build1)
- libcctbx0 (= 2022.9+ds2+~3.11.2+ds1-6build1)
- libgcc-s1 (>= 4.0)
- libgl1
- libglu1-mesa
- libhdf5-103-1
- libmmdb2-0 (>= 2.0.22)
- libssm2 (>= 1.4.0)
- libstdc++6 (>= 11)
- python3 (<< 3.12)
- python3 (>= 3.11~)
- python3
- python3-h5py (>= 3)
- python3-matplotlib
- python3-mrcfile
- python3-numpy (>= 1:1.22.0)
- python3-numpy-abi9
- python3-pil
- python3-pint
- python3-procrunner
- python3-pycbf (>= 0.9.7+dfsg1-2~)
- python3-pymol
- python3-requests
- python3-scipy
- python3-six
- python3-tqdm
- python3-wxgtk4.0