API reference#
Auto-generated module documentation, grouped by topic.
Core#
Atom selection#
Geometry and analysis#
Projections#
- moleculekit.projections.metriccoordinate module
- moleculekit.projections.metricdihedral module
- moleculekit.projections.metricdistance module
- moleculekit.projections.metricfluctuation module
- moleculekit.projections.metricgyration module
- moleculekit.projections.metricplumed2 module
- moleculekit.projections.metricrmsd module
- moleculekit.projections.metricsasa module
- moleculekit.projections.metricsecondarystructure module
- moleculekit.projections.metricshell module
- moleculekit.projections.metricsphericalcoordinate module
- moleculekit.projections.metrictmscore module
- moleculekit.projections.projection module
Interactions#
Toolkit conversion#
File formats#
Tools#
- moleculekit.tools.preparation module
- moleculekit.tools.nonstandard_residues module
- moleculekit.tools.preparation_customres module
- moleculekit.tools.mutate module
- moleculekit.tools.modelling module
- moleculekit.tools.autosegment module
- moleculekit.tools.backbone module
- moleculekit.tools.atomtyper module
- moleculekit.tools.detect module
- moleculekit.tools.docking module
- moleculekit.tools.graphalignment module
- moleculekit.tools.hhblitsprofile module
- moleculekit.tools.moleculechecks module
- moleculekit.tools.sequencestructuralalignment module
- moleculekit.tools.voxeldescriptors module
- moleculekit.tools.crystalpacking module
- moleculekit.tools.obabel_tools package