- recipe maxit
MAXIT assists in the processing and curation of macromolecular structure data.
- Homepage:
- Documentation:
- License:
OTHER / RCSB PDB Software License
- Recipe:
- MAXIT assists in the processing and curation of macromolecular structure data. MAXIT can:
- Read and write PDB and mmCIF format files, and translate between file formats. - Perform consistency checks on coordinates, sequence, and crystal data. - Automatically construct, transform, and merge information between formats - Align residue numbering in the coordinates with the sequence - Reorder and rename atoms in standard and nonstandard residues and ligands according to the Chemical Component Dictionary - Assign ligands the same chain IDs as the adjacent polymers - Detect missing or additional atoms
- package maxit¶
- Versions:
11.400-0,11.300-0,11.200-3,11.200-2,11.200-1,11.200-0- Depends:
on libgcc
>=13on libstdcxx
>=13on tcsh
- Additional platforms:
osx-arm64
Installation¶
You need a conda-compatible package manager (currently either pixi, conda, or micromamba) and the Bioconda channel already activated (see Usage). Below, we show how to install with either pixi or conda (for micromamba and mamba, commands are essentially the same as with conda).
Pixi¶
With pixi installed and the Bioconda channel set up (see Usage), to install globally, run:
pixi global install maxit
to add into an existing workspace instead, run:
pixi add maxit
In the latter case, make sure to first add bioconda and conda-forge to the channels considered by the workspace:
pixi workspace channel add conda-forge
pixi workspace channel add bioconda
Conda¶
With conda installed and the Bioconda channel set up (see Usage), to install into an existing and activated environment, run:
conda install maxit
Alternatively, to install into a new environment, run:
conda create -n envname maxit
with envname being the name of the desired environment.
Container¶
Alternatively, every Bioconda package is available as a container image for usage with your preferred container runtime. For e.g. docker, run:
docker pull quay.io/biocontainers/maxit:<tag>
(see maxit/tags for valid values for <tag>).
Integrated deployment¶
Finally, note that many scientific workflow management systems directly integrate both conda and container based software deployment. Thus, workflow steps can be often directly annotated to use the package, leading to automatic deployment by the respective workflow management system, thereby improving reproducibility and transparency. Check the documentation of your workflow management system to find out about the integration.
Download stats¶
Link to this page¶
Render an 
badge with the following MarkDown:
[](http://bioconda.github.io/recipes/maxit/README.html)
