biotite#

This is the top-level package of Biotite. Although it does not provide useful functionality for most users, it does provide utilities and base classes used by a lot of Biotite’s modules.

File classes#

File

Base class for all file classes.

TextFile

Base class for all line based text files.

Visualization utilities#

plot_scaled_text

Create a matplotlib.textpath.TextPath, whose text size is given in coordinates instead of font size.

AdaptiveFancyArrow

A FancyArrow with fixed head shape.

Miscellaneous#

Copyable

Base class for all objects, that should be copyable.

DeserializationError

InvalidFileError

Indicates that the file is not suitable for the requested action, either because the file does not contain the required data or because the file is malformed.

SerializationError

set_font_size_in_coord

Specifiy the font size of an existing Text object in coordinates of the object's reference coordiante system.

Subpackages#

biotite.interface

This subpackage provides interfaces to other Python packages in the bioinformatics ecosystem.

biotite.interface.rdkit

This subpackage provides an interface to the RDKit cheminformatics package.

biotite.interface.pymol

This package enables the transfer of structures from Biotite to PyMOL for visualization and vice versa, via PyMOL's Python API:

biotite.interface.openmm

This subpackage provides an interface to the OpenMM molecular simulation toolkit.

biotite.structure

A subpackage for handling molecular structures.

biotite.structure.info

A subpackage for obtaining all kinds of chemical information about atoms and residues, including masses, radii, bonds, etc.

biotite.structure.alphabet

A subpackage for converting structures to structural alphabet sequences.

biotite.structure.io

A subpackage for reading and writing structure related data.

biotite.structure.io.xtc

This subpackage is used for reading and writing trajectories in the compressed Gromacs XTC format.

biotite.structure.io.dcd

This subpackage is used for reading and writing trajectories in the CDC format used by software like CHARMM, OpenMM and NAMD.

biotite.structure.io.pdbqt

This subpackage is used for reading and writing an AtomArray or AtomArrayStack using the PDBQT format used by the AutoDock software series.

biotite.structure.io.pdb

This subpackage is used for reading and writing an AtomArray or AtomArrayStack using the popular PDB format.

biotite.structure.io.mol

The MOL format is used to depict atom positions and bonds for small molecules.

biotite.structure.io.netcdf

This subpackage is used for reading and writing trajectories in the AMBER NetCDF format.

biotite.structure.io.trr

This subpackage is used for reading and writing trajectories in the uncompressed Gromacs TRR format.

biotite.structure.io.pdbx

This subpackage provides support for the the modern PDBx file formats.

biotite.structure.io.gro

This subpackage is used for reading and writing an AtomArray or AtomArrayStack using the Gro format used by the gromacs software package.

biotite.structure.graphics

A subpackage for visualizing structure related objects.

biotite.database

A subpackage for fetching data from online databases.

biotite.database.uniprot

A subpackage for downloading files from the UniProt.

biotite.database.pubchem

A subpackage for searching and downloading files from the PubChem database.

biotite.database.rcsb

A subpackage for downloading files from the RCSB PDB.

biotite.database.afdb

A subpackage for downloading predicted protein structures from the AlphaFold DB.

biotite.database.entrez

A subpackage for downloading files from the NCBI Entrez database.

biotite.sequence

A subpackage for handling sequences.

biotite.sequence.align

This subpackage provides functionality for sequence alignments.

biotite.sequence.phylo

This subpackage provides functions and data structures for creating (phylogenetic) trees.

biotite.sequence.io

A subpackage for reading and writing sequence related data.

biotite.sequence.io.fastq

This subpackage is used for reading and writing sequencing data using the popular FASTQ format.

biotite.sequence.io.fasta

This subpackage is used for reading and writing sequence objects using the popular FASTA format.

biotite.sequence.io.clustal

This subpackage is used for reading and writing sequence alignment objects using the ClustalW format (.aln).

biotite.sequence.io.gff

This subpackage is used for reading and writing sequence features in the Generic Feature Format 3 (GFF3).

biotite.sequence.io.genbank

This subpackage is used for reading/writing information (especially sequence features) from/to files in the GenBank and GenPept format.

biotite.sequence.graphics

A subpackage for visualization of sequence related objects.

biotite.application

A subpackage that provides interfaces for external software in case Biotite’s integrated functionality is not sufficient for your tasks.

biotite.application.viennarna

A subpackage that provides interfaces to the ViennaRNA software package.

biotite.application.clustalo

A subpackage for multiple sequence alignments using Clustal-Omega.

biotite.application.dssp

A subpackage for protein secondary structure annotation using DSSP.

biotite.application.mafft

A subpackage for multiple sequence alignments using MAFFT.

biotite.application.autodock

A subpackage for static ligand docking with Autodock.

biotite.application.tantan

A subpackage for masking sequence regions using the tantan software.

biotite.application.muscle

A subpackage for multiple sequence alignments using MUSCLE.

biotite.application.blast

A subpackage for heuristic local alignments against a large database using BLAST.

biotite.application.sra

A subpackage for obtaining sequencing data from the NCBI sequence read archive (SRA).