matterviz 0.3.7 → 0.4.1
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/dist/Icon.svelte +7 -4
- package/dist/MillerIndexInput.svelte +1 -1
- package/dist/api/optimade.js +32 -26
- package/dist/app.css +0 -3
- package/dist/brillouin/BrillouinZone.svelte +76 -148
- package/dist/brillouin/BrillouinZone.svelte.d.ts +6 -14
- package/dist/brillouin/BrillouinZoneExportPane.svelte +43 -96
- package/dist/brillouin/BrillouinZoneExportPane.svelte.d.ts +1 -1
- package/dist/brillouin/BrillouinZoneInfoPane.svelte +9 -32
- package/dist/brillouin/BrillouinZoneInfoPane.svelte.d.ts +2 -3
- package/dist/brillouin/BrillouinZoneScene.svelte +97 -205
- package/dist/brillouin/BrillouinZoneScene.svelte.d.ts +4 -23
- package/dist/brillouin/BrillouinZoneTooltip.svelte +16 -25
- package/dist/brillouin/ReciprocalVectors.svelte +39 -0
- package/dist/brillouin/ReciprocalVectors.svelte.d.ts +9 -0
- package/dist/brillouin/compute.d.ts +2 -0
- package/dist/brillouin/compute.js +89 -90
- package/dist/brillouin/geometry.d.ts +8 -0
- package/dist/brillouin/geometry.js +57 -0
- package/dist/brillouin/index.d.ts +2 -0
- package/dist/brillouin/index.js +2 -0
- package/dist/brillouin/types.d.ts +2 -2
- package/dist/chempot-diagram/ChemPotDiagram.svelte +14 -13
- package/dist/chempot-diagram/ChemPotDiagram.svelte.d.ts +1 -1
- package/dist/chempot-diagram/ChemPotDiagram2D.svelte +109 -203
- package/dist/chempot-diagram/ChemPotDiagram2D.svelte.d.ts +4 -1
- package/dist/chempot-diagram/ChemPotDiagram3D.svelte +180 -470
- package/dist/chempot-diagram/ChemPotDiagram3D.svelte.d.ts +7 -1
- package/dist/chempot-diagram/async-compute.svelte.js +3 -1
- package/dist/chempot-diagram/chempot-worker.js +2 -1
- package/dist/chempot-diagram/color.d.ts +3 -6
- package/dist/chempot-diagram/color.js +5 -5
- package/dist/chempot-diagram/compute.d.ts +4 -4
- package/dist/chempot-diagram/compute.js +20 -20
- package/dist/chempot-diagram/controls-state.svelte.d.ts +10 -0
- package/dist/chempot-diagram/controls-state.svelte.js +42 -0
- package/dist/chempot-diagram/export.d.ts +47 -0
- package/dist/chempot-diagram/export.js +133 -0
- package/dist/chempot-diagram/index.d.ts +1 -0
- package/dist/chempot-diagram/index.js +1 -0
- package/dist/chempot-diagram/pointer.d.ts +0 -10
- package/dist/chempot-diagram/pointer.js +4 -4
- package/dist/chempot-diagram/types.d.ts +3 -3
- package/dist/colors/index.js +8 -7
- package/dist/composition/FormulaFilter.svelte +18 -11
- package/dist/composition/PieChart.svelte +11 -10
- package/dist/composition/chem-sys.d.ts +8 -0
- package/dist/composition/chem-sys.js +86 -0
- package/dist/composition/format.js +7 -4
- package/dist/composition/index.d.ts +1 -0
- package/dist/composition/index.js +1 -0
- package/dist/composition/parse.d.ts +0 -1
- package/dist/composition/parse.js +41 -31
- package/dist/controls.d.ts +1 -0
- package/dist/controls.js +0 -1
- package/dist/convex-hull/ConvexHull.svelte +8 -10
- package/dist/convex-hull/ConvexHull.svelte.d.ts +1 -4
- package/dist/convex-hull/ConvexHull2D.svelte +106 -185
- package/dist/convex-hull/ConvexHull2D.svelte.d.ts +1 -1
- package/dist/convex-hull/ConvexHull3D.svelte +179 -683
- package/dist/convex-hull/ConvexHull3D.svelte.d.ts +1 -1
- package/dist/convex-hull/ConvexHull4D.svelte +183 -687
- package/dist/convex-hull/ConvexHull4D.svelte.d.ts +1 -1
- package/dist/convex-hull/ConvexHullChrome.svelte +268 -0
- package/dist/convex-hull/ConvexHullChrome.svelte.d.ts +30 -0
- package/dist/convex-hull/ConvexHullControls.svelte +88 -7
- package/dist/convex-hull/ConvexHullControls.svelte.d.ts +7 -6
- package/dist/convex-hull/ConvexHullInfoPane.svelte +18 -5
- package/dist/convex-hull/ConvexHullInfoPane.svelte.d.ts +6 -5
- package/dist/convex-hull/ConvexHullStats.svelte +36 -175
- package/dist/convex-hull/ConvexHullStats.svelte.d.ts +3 -1
- package/dist/convex-hull/ConvexHullTooltip.svelte +11 -2
- package/dist/convex-hull/ConvexHullTooltip.svelte.d.ts +2 -1
- package/dist/convex-hull/GasPressureControls.svelte +4 -4
- package/dist/convex-hull/TemperatureSlider.svelte +2 -2
- package/dist/convex-hull/barycentric-coords.d.ts +2 -4
- package/dist/convex-hull/barycentric-coords.js +6 -33
- package/dist/convex-hull/canvas-interactions.svelte.d.ts +79 -0
- package/dist/convex-hull/canvas-interactions.svelte.js +278 -0
- package/dist/convex-hull/demo-temperature.d.ts +1 -1
- package/dist/convex-hull/demo-temperature.js +20 -22
- package/dist/convex-hull/gas-thermodynamics.d.ts +2 -2
- package/dist/convex-hull/gas-thermodynamics.js +22 -30
- package/dist/convex-hull/helpers.d.ts +42 -7
- package/dist/convex-hull/helpers.js +171 -78
- package/dist/convex-hull/hull-state.svelte.d.ts +44 -0
- package/dist/convex-hull/hull-state.svelte.js +124 -0
- package/dist/convex-hull/index.d.ts +10 -8
- package/dist/convex-hull/index.js +7 -2
- package/dist/convex-hull/thermodynamics.js +136 -960
- package/dist/convex-hull/types.d.ts +13 -5
- package/dist/convex-hull/types.js +12 -0
- package/dist/coordination/CoordinationBarPlot.svelte +27 -34
- package/dist/coordination/CoordinationBarPlot.svelte.d.ts +1 -1
- package/dist/element/BohrAtom.svelte +2 -1
- package/dist/element/index.d.ts +4 -0
- package/dist/element/index.js +18 -0
- package/dist/feedback/DragOverlay.svelte +3 -1
- package/dist/feedback/DragOverlay.svelte.d.ts +1 -0
- package/dist/feedback/StatusMessage.svelte +13 -3
- package/dist/fermi-surface/FermiSlice.svelte +13 -5
- package/dist/fermi-surface/FermiSurface.svelte +78 -151
- package/dist/fermi-surface/FermiSurface.svelte.d.ts +5 -14
- package/dist/fermi-surface/FermiSurfaceControls.svelte +1 -1
- package/dist/fermi-surface/FermiSurfaceControls.svelte.d.ts +1 -1
- package/dist/fermi-surface/FermiSurfaceScene.svelte +72 -221
- package/dist/fermi-surface/FermiSurfaceScene.svelte.d.ts +3 -23
- package/dist/fermi-surface/FermiSurfaceTooltip.svelte +8 -34
- package/dist/fermi-surface/compute.js +67 -66
- package/dist/fermi-surface/export.js +6 -16
- package/dist/fermi-surface/index.d.ts +0 -1
- package/dist/fermi-surface/index.js +0 -1
- package/dist/fermi-surface/parse.d.ts +1 -1
- package/dist/fermi-surface/parse.js +71 -79
- package/dist/fermi-surface/types.d.ts +3 -2
- package/dist/heatmap-matrix/HeatmapMatrix.svelte +69 -52
- package/dist/heatmap-matrix/HeatmapMatrix.svelte.d.ts +4 -3
- package/dist/heatmap-matrix/HeatmapMatrixControls.svelte +3 -2
- package/dist/heatmap-matrix/HeatmapMatrixControls.svelte.d.ts +5 -5
- package/dist/heatmap-matrix/index.d.ts +3 -2
- package/dist/heatmap-matrix/index.js +1 -1
- package/dist/index.d.ts +1 -0
- package/dist/index.js +1 -0
- package/dist/io/ExportPane.svelte +166 -0
- package/dist/io/ExportPane.svelte.d.ts +17 -0
- package/dist/io/decompress.js +5 -4
- package/dist/io/export.d.ts +9 -5
- package/dist/io/export.js +77 -51
- package/dist/io/fetch.d.ts +2 -1
- package/dist/io/fetch.js +5 -1
- package/dist/io/file-drop.d.ts +8 -1
- package/dist/io/file-drop.js +48 -36
- package/dist/io/index.d.ts +2 -0
- package/dist/io/index.js +10 -0
- package/dist/io/types.d.ts +13 -0
- package/dist/io/url-drop.js +64 -33
- package/dist/isosurface/parse.js +52 -51
- package/dist/isosurface/slice.js +5 -4
- package/dist/isosurface/types.js +1 -1
- package/dist/keyboard.d.ts +3 -0
- package/dist/keyboard.js +23 -0
- package/dist/labels.d.ts +1 -1
- package/dist/labels.js +9 -8
- package/dist/layout/FullscreenButton.svelte +33 -0
- package/dist/layout/FullscreenButton.svelte.d.ts +10 -0
- package/dist/layout/FullscreenToggle.svelte +8 -14
- package/dist/layout/PropertyFilter.svelte +3 -2
- package/dist/layout/SettingsSection.svelte +1 -1
- package/dist/layout/ViewerChrome.svelte +116 -0
- package/dist/layout/ViewerChrome.svelte.d.ts +17 -0
- package/dist/layout/fullscreen.d.ts +4 -0
- package/dist/layout/fullscreen.svelte.d.ts +8 -0
- package/dist/layout/fullscreen.svelte.js +37 -0
- package/dist/layout/index.d.ts +3 -0
- package/dist/layout/index.js +3 -0
- package/dist/layout/json-tree/JsonNode.svelte +1 -1
- package/dist/layout/json-tree/JsonTree.svelte +2 -2
- package/dist/layout/json-tree/utils.js +5 -4
- package/dist/marching-cubes.js +8 -13
- package/dist/math.d.ts +12 -4
- package/dist/math.js +42 -30
- package/dist/overlays/DraggablePane.svelte +4 -4
- package/dist/overlays/index.d.ts +4 -0
- package/dist/periodic-table/PeriodicTable.svelte +27 -15
- package/dist/periodic-table/PropertySelect.svelte +1 -0
- package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte +9 -3
- package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte.d.ts +1 -1
- package/dist/phase-diagram/PhaseDiagramControls.svelte +3 -2
- package/dist/phase-diagram/PhaseDiagramControls.svelte.d.ts +4 -3
- package/dist/phase-diagram/PhaseDiagramEditorPane.svelte +4 -2
- package/dist/phase-diagram/PhaseDiagramEditorPane.svelte.d.ts +2 -3
- package/dist/phase-diagram/PhaseDiagramExportPane.svelte +47 -132
- package/dist/phase-diagram/PhaseDiagramExportPane.svelte.d.ts +3 -4
- package/dist/phase-diagram/PhaseDiagramTooltip.svelte +1 -1
- package/dist/phase-diagram/build-diagram.js +2 -2
- package/dist/phase-diagram/colors.js +1 -1
- package/dist/phase-diagram/parse.d.ts +2 -1
- package/dist/phase-diagram/parse.js +6 -5
- package/dist/phase-diagram/types.d.ts +1 -1
- package/dist/phase-diagram/utils.d.ts +3 -3
- package/dist/phase-diagram/utils.js +8 -12
- package/dist/plot/{BarPlot.svelte → bar/BarPlot.svelte} +246 -841
- package/dist/plot/{BarPlot.svelte.d.ts → bar/BarPlot.svelte.d.ts} +8 -16
- package/dist/plot/{BarPlotControls.svelte → bar/BarPlotControls.svelte} +6 -5
- package/dist/plot/{BarPlotControls.svelte.d.ts → bar/BarPlotControls.svelte.d.ts} +3 -3
- package/dist/plot/{SpacegroupBarPlot.svelte → bar/SpacegroupBarPlot.svelte} +8 -7
- package/dist/plot/{SpacegroupBarPlot.svelte.d.ts → bar/SpacegroupBarPlot.svelte.d.ts} +1 -1
- package/dist/plot/bar/data.d.ts +40 -0
- package/dist/plot/bar/data.js +154 -0
- package/dist/plot/bar/geometry.d.ts +39 -0
- package/dist/plot/bar/geometry.js +60 -0
- package/dist/plot/bar/index.d.ts +3 -0
- package/dist/plot/bar/index.js +3 -0
- package/dist/plot/box/BoxPlot.svelte +1292 -0
- package/dist/plot/box/BoxPlot.svelte.d.ts +95 -0
- package/dist/plot/box/BoxPlotControls.svelte +109 -0
- package/dist/plot/box/BoxPlotControls.svelte.d.ts +19 -0
- package/dist/plot/box/Violin.svelte +14 -0
- package/dist/plot/box/Violin.svelte.d.ts +70 -0
- package/dist/plot/box/box-plot.d.ts +56 -0
- package/dist/plot/box/box-plot.js +129 -0
- package/dist/plot/box/index.d.ts +5 -0
- package/dist/plot/box/index.js +5 -0
- package/dist/plot/box/kde.d.ts +17 -0
- package/dist/plot/box/kde.js +160 -0
- package/dist/plot/box/quantile.d.ts +3 -0
- package/dist/plot/box/quantile.js +53 -0
- package/dist/plot/{auto-place.d.ts → core/auto-place.d.ts} +1 -1
- package/dist/plot/{auto-place.js → core/auto-place.js} +6 -3
- package/dist/plot/core/axis-utils.d.ts +46 -0
- package/dist/plot/core/axis-utils.js +110 -0
- package/dist/plot/{AxisLabel.svelte → core/components/AxisLabel.svelte} +2 -2
- package/dist/plot/{AxisLabel.svelte.d.ts → core/components/AxisLabel.svelte.d.ts} +1 -1
- package/dist/plot/{ColorBar.svelte → core/components/ColorBar.svelte} +41 -38
- package/dist/plot/{ColorBar.svelte.d.ts → core/components/ColorBar.svelte.d.ts} +7 -6
- package/dist/plot/{ColorScaleSelect.svelte → core/components/ColorScaleSelect.svelte} +4 -3
- package/dist/plot/{ColorScaleSelect.svelte.d.ts → core/components/ColorScaleSelect.svelte.d.ts} +2 -2
- package/dist/plot/core/components/ControlPane.svelte +46 -0
- package/dist/plot/core/components/ControlPane.svelte.d.ts +13 -0
- package/dist/plot/{FillArea.svelte → core/components/FillArea.svelte} +17 -6
- package/dist/plot/{FillArea.svelte.d.ts → core/components/FillArea.svelte.d.ts} +1 -1
- package/dist/plot/{InteractiveAxisLabel.svelte → core/components/InteractiveAxisLabel.svelte} +3 -3
- package/dist/plot/{InteractiveAxisLabel.svelte.d.ts → core/components/InteractiveAxisLabel.svelte.d.ts} +2 -2
- package/dist/plot/{Line.svelte → core/components/Line.svelte} +33 -15
- package/dist/plot/{Line.svelte.d.ts → core/components/Line.svelte.d.ts} +3 -2
- package/dist/plot/{PlotAxis.svelte → core/components/PlotAxis.svelte} +9 -6
- package/dist/plot/{PlotAxis.svelte.d.ts → core/components/PlotAxis.svelte.d.ts} +5 -3
- package/dist/plot/{PlotControls.svelte → core/components/PlotControls.svelte} +17 -29
- package/dist/plot/core/components/PlotControls.svelte.d.ts +4 -0
- package/dist/plot/{PlotLegend.svelte → core/components/PlotLegend.svelte} +21 -10
- package/dist/plot/{PlotLegend.svelte.d.ts → core/components/PlotLegend.svelte.d.ts} +3 -2
- package/dist/plot/{PlotTooltip.svelte → core/components/PlotTooltip.svelte} +17 -1
- package/dist/plot/{PlotTooltip.svelte.d.ts → core/components/PlotTooltip.svelte.d.ts} +8 -0
- package/dist/plot/{PortalSelect.svelte → core/components/PortalSelect.svelte} +11 -7
- package/dist/plot/{ReferenceLine.svelte → core/components/ReferenceLine.svelte} +3 -3
- package/dist/plot/{ReferenceLine.svelte.d.ts → core/components/ReferenceLine.svelte.d.ts} +1 -1
- package/dist/plot/{ReferenceLine3D.svelte → core/components/ReferenceLine3D.svelte} +5 -5
- package/dist/plot/{ReferenceLine3D.svelte.d.ts → core/components/ReferenceLine3D.svelte.d.ts} +5 -5
- package/dist/plot/{ReferencePlane.svelte → core/components/ReferencePlane.svelte} +8 -8
- package/dist/plot/{ReferencePlane.svelte.d.ts → core/components/ReferencePlane.svelte.d.ts} +5 -5
- package/dist/plot/{ZeroLines.svelte → core/components/ZeroLines.svelte} +3 -3
- package/dist/plot/{ZeroLines.svelte.d.ts → core/components/ZeroLines.svelte.d.ts} +3 -3
- package/dist/plot/{ZoomRect.svelte → core/components/ZoomRect.svelte} +1 -1
- package/dist/plot/{ZoomRect.svelte.d.ts → core/components/ZoomRect.svelte.d.ts} +1 -1
- package/dist/plot/core/components/index.d.ts +17 -0
- package/dist/plot/core/components/index.js +17 -0
- package/dist/plot/{data-cleaning.d.ts → core/data-cleaning.d.ts} +71 -1
- package/dist/plot/{data-cleaning.js → core/data-cleaning.js} +21 -23
- package/dist/plot/{data-transform.d.ts → core/data-transform.d.ts} +2 -2
- package/dist/plot/{data-transform.js → core/data-transform.js} +3 -3
- package/dist/plot/core/fill-utils.d.ts +34 -0
- package/dist/plot/core/fill-utils.js +391 -0
- package/dist/plot/core/index.d.ts +10 -0
- package/dist/plot/core/index.js +11 -0
- package/dist/plot/core/interactions.d.ts +39 -0
- package/dist/plot/core/interactions.js +209 -0
- package/dist/plot/{layout.d.ts → core/layout.d.ts} +1 -0
- package/dist/plot/{layout.js → core/layout.js} +16 -8
- package/dist/plot/core/pan-zoom.svelte.d.ts +35 -0
- package/dist/plot/core/pan-zoom.svelte.js +221 -0
- package/dist/plot/core/placed-tween.svelte.d.ts +21 -0
- package/dist/plot/core/placed-tween.svelte.js +68 -0
- package/dist/plot/{reference-line.d.ts → core/reference-line.d.ts} +11 -11
- package/dist/plot/{reference-line.js → core/reference-line.js} +29 -42
- package/dist/plot/core/scales.d.ts +40 -0
- package/dist/plot/{scales.js → core/scales.js} +94 -93
- package/dist/plot/core/svg.d.ts +3 -0
- package/dist/plot/core/svg.js +41 -0
- package/dist/plot/{types.d.ts → core/types.d.ts} +36 -85
- package/dist/plot/{types.js → core/types.js} +1 -1
- package/dist/plot/{utils → core/utils}/label-placement.d.ts +3 -3
- package/dist/plot/{utils → core/utils}/label-placement.js +3 -3
- package/dist/plot/core/utils/series-visibility.d.ts +26 -0
- package/dist/plot/{utils → core/utils}/series-visibility.js +29 -2
- package/dist/plot/core/utils.d.ts +12 -0
- package/dist/plot/core/utils.js +27 -0
- package/dist/plot/{Histogram.svelte → histogram/Histogram.svelte} +174 -551
- package/dist/plot/{Histogram.svelte.d.ts → histogram/Histogram.svelte.d.ts} +2 -2
- package/dist/plot/{HistogramControls.svelte → histogram/HistogramControls.svelte} +6 -6
- package/dist/plot/{HistogramControls.svelte.d.ts → histogram/HistogramControls.svelte.d.ts} +4 -4
- package/dist/plot/histogram/index.d.ts +2 -0
- package/dist/plot/histogram/index.js +2 -0
- package/dist/plot/index.d.ts +8 -41
- package/dist/plot/index.js +10 -39
- package/dist/plot/sankey/Sankey.svelte +697 -0
- package/dist/plot/sankey/Sankey.svelte.d.ts +74 -0
- package/dist/plot/sankey/SankeyControls.svelte +98 -0
- package/dist/plot/sankey/SankeyControls.svelte.d.ts +19 -0
- package/dist/plot/sankey/index.d.ts +4 -0
- package/dist/plot/sankey/index.js +3 -0
- package/dist/plot/sankey/sankey-types.d.ts +42 -0
- package/dist/plot/sankey/sankey-types.js +4 -0
- package/dist/plot/sankey/sankey.d.ts +52 -0
- package/dist/plot/sankey/sankey.js +189 -0
- package/dist/plot/{BinnedScatterPlot.svelte → scatter/BinnedScatterPlot.svelte} +64 -64
- package/dist/plot/{BinnedScatterPlot.svelte.d.ts → scatter/BinnedScatterPlot.svelte.d.ts} +6 -6
- package/dist/plot/{ElementScatter.svelte → scatter/ElementScatter.svelte} +6 -6
- package/dist/plot/{ElementScatter.svelte.d.ts → scatter/ElementScatter.svelte.d.ts} +2 -2
- package/dist/plot/{ScatterPlot.svelte → scatter/ScatterPlot.svelte} +297 -1008
- package/dist/plot/{ScatterPlot.svelte.d.ts → scatter/ScatterPlot.svelte.d.ts} +10 -18
- package/dist/plot/{ScatterPlotControls.svelte → scatter/ScatterPlotControls.svelte} +6 -5
- package/dist/plot/{ScatterPlotControls.svelte.d.ts → scatter/ScatterPlotControls.svelte.d.ts} +2 -2
- package/dist/plot/{ScatterPoint.svelte → scatter/ScatterPoint.svelte} +7 -7
- package/dist/plot/{ScatterPoint.svelte.d.ts → scatter/ScatterPoint.svelte.d.ts} +3 -3
- package/dist/plot/{adaptive-density.d.ts → scatter/adaptive-density.d.ts} +14 -4
- package/dist/plot/{adaptive-density.js → scatter/adaptive-density.js} +46 -20
- package/dist/plot/{binned-scatter-types.d.ts → scatter/binned-scatter-types.d.ts} +5 -12
- package/dist/plot/scatter/index.d.ts +7 -0
- package/dist/plot/scatter/index.js +5 -0
- package/dist/plot/scatter/scatter-data.d.ts +19 -0
- package/dist/plot/scatter/scatter-data.js +212 -0
- package/dist/plot/{ScatterPlot3D.svelte → scatter-3d/ScatterPlot3D.svelte} +25 -34
- package/dist/plot/{ScatterPlot3D.svelte.d.ts → scatter-3d/ScatterPlot3D.svelte.d.ts} +9 -17
- package/dist/plot/{ScatterPlot3DControls.svelte → scatter-3d/ScatterPlot3DControls.svelte} +14 -14
- package/dist/plot/{ScatterPlot3DControls.svelte.d.ts → scatter-3d/ScatterPlot3DControls.svelte.d.ts} +6 -6
- package/dist/plot/{ScatterPlot3DScene.svelte → scatter-3d/ScatterPlot3DScene.svelte} +129 -128
- package/dist/plot/{ScatterPlot3DScene.svelte.d.ts → scatter-3d/ScatterPlot3DScene.svelte.d.ts} +6 -15
- package/dist/plot/{Surface3D.svelte → scatter-3d/Surface3D.svelte} +7 -6
- package/dist/plot/{Surface3D.svelte.d.ts → scatter-3d/Surface3D.svelte.d.ts} +5 -4
- package/dist/plot/scatter-3d/index.d.ts +4 -0
- package/dist/plot/scatter-3d/index.js +4 -0
- package/dist/plot/sunburst/Sunburst.svelte +1041 -0
- package/dist/plot/sunburst/Sunburst.svelte.d.ts +97 -0
- package/dist/plot/sunburst/SunburstControls.svelte +200 -0
- package/dist/plot/sunburst/SunburstControls.svelte.d.ts +26 -0
- package/dist/plot/sunburst/index.d.ts +4 -0
- package/dist/plot/sunburst/index.js +4 -0
- package/dist/plot/sunburst/render.d.ts +34 -0
- package/dist/plot/sunburst/render.js +122 -0
- package/dist/plot/sunburst/sunburst.d.ts +62 -0
- package/dist/plot/sunburst/sunburst.js +269 -0
- package/dist/rdf/RdfPlot.svelte +2 -1
- package/dist/rdf/RdfPlot.svelte.d.ts +1 -1
- package/dist/rdf/calc-rdf.js +11 -24
- package/dist/sanitize.js +14 -3
- package/dist/scene/SceneCamera.svelte +62 -0
- package/dist/scene/SceneCamera.svelte.d.ts +19 -0
- package/dist/scene/bind-renderer.svelte.d.ts +2 -0
- package/dist/scene/bind-renderer.svelte.js +14 -0
- package/dist/scene/index.d.ts +4 -0
- package/dist/scene/index.js +5 -0
- package/dist/scene/props.js +52 -0
- package/dist/scene/types.d.ts +26 -0
- package/dist/scene/types.js +1 -0
- package/dist/settings.d.ts +79 -3
- package/dist/settings.js +321 -1
- package/dist/spectral/Bands.svelte +47 -36
- package/dist/spectral/Bands.svelte.d.ts +6 -6
- package/dist/spectral/BandsAndDos.svelte +23 -25
- package/dist/spectral/BrillouinBandsDos.svelte +42 -30
- package/dist/spectral/Dos.svelte +15 -23
- package/dist/spectral/Dos.svelte.d.ts +4 -3
- package/dist/spectral/helpers.d.ts +8 -6
- package/dist/spectral/helpers.js +137 -65
- package/dist/state.svelte.d.ts +0 -7
- package/dist/state.svelte.js +0 -6
- package/dist/structure/Arrow.svelte +2 -4
- package/dist/structure/AtomLegend.svelte +8 -9
- package/dist/structure/AtomLegend.svelte.d.ts +1 -1
- package/dist/structure/CanvasTooltip.svelte +1 -0
- package/dist/structure/CellSelect.svelte +12 -5
- package/dist/structure/CellSelect.svelte.d.ts +2 -1
- package/dist/structure/Cylinder.svelte +12 -8
- package/dist/structure/Cylinder.svelte.d.ts +4 -1
- package/dist/structure/Lattice.svelte +2 -2
- package/dist/structure/Structure.svelte +365 -423
- package/dist/structure/Structure.svelte.d.ts +5 -15
- package/dist/structure/StructureControls.svelte +217 -2
- package/dist/structure/StructureControls.svelte.d.ts +5 -3
- package/dist/structure/StructureExportPane.svelte +54 -156
- package/dist/structure/StructureExportPane.svelte.d.ts +4 -5
- package/dist/structure/StructureInfoPane.svelte +10 -9
- package/dist/structure/StructureInfoPane.svelte.d.ts +5 -5
- package/dist/structure/StructureScene.svelte +376 -208
- package/dist/structure/StructureScene.svelte.d.ts +22 -20
- package/dist/structure/{label-placement.d.ts → atom-label-placement.d.ts} +3 -3
- package/dist/structure/{label-placement.js → atom-label-placement.js} +15 -5
- package/dist/structure/atom-properties.d.ts +1 -1
- package/dist/structure/atom-properties.js +17 -22
- package/dist/structure/bond-order-perception.js +3 -5
- package/dist/structure/bonding.d.ts +4 -0
- package/dist/structure/bonding.js +134 -63
- package/dist/structure/export.d.ts +24 -4
- package/dist/structure/export.js +89 -143
- package/dist/structure/index.d.ts +4 -4
- package/dist/structure/index.js +3 -3
- package/dist/structure/measure.d.ts +3 -2
- package/dist/structure/measure.js +6 -5
- package/dist/structure/parse.d.ts +3 -2
- package/dist/structure/parse.js +419 -438
- package/dist/structure/partial-occupancy.d.ts +0 -1
- package/dist/structure/partial-occupancy.js +1 -1
- package/dist/structure/pbc.d.ts +1 -1
- package/dist/structure/pbc.js +190 -13
- package/dist/structure/polyhedra.d.ts +41 -0
- package/dist/structure/polyhedra.js +602 -0
- package/dist/structure/site.d.ts +4 -0
- package/dist/structure/site.js +1 -0
- package/dist/structure/supercell.js +3 -2
- package/dist/structure/validation.js +5 -6
- package/dist/symmetry/SymmetryElementControls.svelte +69 -0
- package/dist/symmetry/SymmetryElementControls.svelte.d.ts +9 -0
- package/dist/symmetry/SymmetryElements.svelte +354 -0
- package/dist/symmetry/SymmetryElements.svelte.d.ts +24 -0
- package/dist/symmetry/SymmetryStats.svelte +113 -8
- package/dist/symmetry/WyckoffTable.svelte +68 -7
- package/dist/symmetry/WyckoffTable.svelte.d.ts +3 -0
- package/dist/symmetry/cell-transform.js +7 -14
- package/dist/symmetry/index.d.ts +14 -4
- package/dist/symmetry/index.js +291 -72
- package/dist/symmetry/spacegroups.d.ts +12 -1
- package/dist/symmetry/spacegroups.js +63 -14
- package/dist/symmetry/symmetry-elements.d.ts +33 -0
- package/dist/symmetry/symmetry-elements.js +521 -0
- package/dist/symmetry/wyckoff-db.d.ts +9 -0
- package/dist/symmetry/wyckoff-db.js +87 -0
- package/dist/table/HeatmapTable.svelte +66 -25
- package/dist/table/HeatmapTable.svelte.d.ts +1 -1
- package/dist/table/index.d.ts +1 -3
- package/dist/table/index.js +1 -1
- package/dist/theme/index.js +8 -8
- package/dist/tooltip/KCoords.svelte +45 -0
- package/dist/tooltip/KCoords.svelte.d.ts +8 -0
- package/dist/tooltip/index.d.ts +1 -0
- package/dist/tooltip/index.js +1 -0
- package/dist/trajectory/Trajectory.svelte +123 -100
- package/dist/trajectory/Trajectory.svelte.d.ts +11 -22
- package/dist/trajectory/TrajectoryExportPane.svelte +17 -25
- package/dist/trajectory/TrajectoryExportPane.svelte.d.ts +4 -5
- package/dist/trajectory/TrajectoryInfoPane.svelte +5 -3
- package/dist/trajectory/TrajectoryInfoPane.svelte.d.ts +3 -2
- package/dist/trajectory/constants.js +6 -2
- package/dist/trajectory/extract.js +17 -37
- package/dist/trajectory/format-detect.d.ts +1 -1
- package/dist/trajectory/format-detect.js +27 -19
- package/dist/trajectory/frame-reader.d.ts +0 -1
- package/dist/trajectory/frame-reader.js +63 -162
- package/dist/trajectory/helpers.d.ts +10 -2
- package/dist/trajectory/helpers.js +56 -36
- package/dist/trajectory/index.js +1 -1
- package/dist/trajectory/parse/ase.d.ts +9 -1
- package/dist/trajectory/parse/ase.js +47 -32
- package/dist/trajectory/parse/diagnostics.d.ts +3 -0
- package/dist/trajectory/parse/diagnostics.js +14 -0
- package/dist/trajectory/parse/hdf5.js +1 -1
- package/dist/trajectory/parse/index.d.ts +1 -1
- package/dist/trajectory/parse/index.js +65 -105
- package/dist/trajectory/parse/lammps.d.ts +0 -2
- package/dist/trajectory/parse/lammps.js +8 -6
- package/dist/trajectory/parse/pymatgen.d.ts +2 -0
- package/dist/trajectory/parse/pymatgen.js +74 -0
- package/dist/trajectory/parse/vasp.js +38 -18
- package/dist/trajectory/parse/xyz.d.ts +13 -1
- package/dist/trajectory/parse/xyz.js +102 -94
- package/dist/trajectory/plotting.d.ts +1 -2
- package/dist/trajectory/plotting.js +16 -113
- package/dist/utils.d.ts +2 -0
- package/dist/utils.js +7 -5
- package/dist/xrd/XrdPlot.svelte +16 -30
- package/dist/xrd/broadening.d.ts +2 -1
- package/dist/xrd/calc-xrd.js +18 -20
- package/dist/xrd/index.d.ts +2 -2
- package/dist/xrd/parse.js +2 -2
- package/package.json +43 -26
- package/dist/element/data.json +0 -11864
- package/dist/fermi-surface/marching-cubes.d.ts +0 -2
- package/dist/fermi-surface/marching-cubes.js +0 -2
- package/dist/plot/PlotControls.svelte.d.ts +0 -4
- package/dist/plot/axis-utils.d.ts +0 -19
- package/dist/plot/axis-utils.js +0 -78
- package/dist/plot/defaults.d.ts +0 -19
- package/dist/plot/defaults.js +0 -9
- package/dist/plot/fill-utils.d.ts +0 -46
- package/dist/plot/fill-utils.js +0 -322
- package/dist/plot/hover-lock.svelte.d.ts +0 -14
- package/dist/plot/hover-lock.svelte.js +0 -46
- package/dist/plot/interactions.d.ts +0 -12
- package/dist/plot/interactions.js +0 -101
- package/dist/plot/scales.d.ts +0 -48
- package/dist/plot/svg.d.ts +0 -1
- package/dist/plot/svg.js +0 -11
- package/dist/plot/utils/series-visibility.d.ts +0 -15
- package/dist/plot/utils.d.ts +0 -1
- package/dist/plot/utils.js +0 -14
- /package/dist/plot/{PortalSelect.svelte.d.ts → core/components/PortalSelect.svelte.d.ts} +0 -0
- /package/dist/plot/{binned-scatter-types.js → scatter/binned-scatter-types.js} +0 -0
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import type { Vec2 } from '../../math';
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import type { BandwidthOption, BasePlotProps, BoxHandlerProps, BoxPlotSeries, LegendConfig, Orientation, PanConfig, PlotConfig, RefLine, RefLineEvent, UserContentProps, ViolinKind, ViolinSide, WhiskerMode } from '..';
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declare function $$render<Metadata extends Record<string, unknown> = Record<string, unknown>>(): {
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series?: BoxPlotSeries<Metadata>[];
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kind?: ViolinKind;
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bindings: "display" | "orientation" | "show_controls" | "x2_axis" | "y_axis" | "y2_axis" | "fullscreen" | "series" | "hovered" | "ref_lines" | "controls_open" | "x_axis" | "kind" | "side" | "whisker_mode" | "show_outliers" | "show_mean";
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declare class __sveltets_Render<Metadata extends Record<string, unknown> = Record<string, unknown>> {
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events(): ReturnType<typeof $$render<Metadata>>['events'];
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slots(): ReturnType<typeof $$render<Metadata>>['slots'];
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bindings(): "display" | "orientation" | "show_controls" | "x2_axis" | "y_axis" | "y2_axis" | "fullscreen" | "series" | "hovered" | "ref_lines" | "controls_open" | "x_axis" | "kind" | "side" | "whisker_mode" | "show_outliers" | "show_mean";
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interface $$IsomorphicComponent {
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declare const BoxPlot: $$IsomorphicComponent;
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<script lang="ts">
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kind = $bindable(`box`),
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display = $bindable({}),
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children,
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...rest
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}: Omit<PlotControlsProps, `children` | `post_children`> & {
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children?: Snippet<[{ orientation: Orientation } & Required<PlotConfig>]>
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} = $props()
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</script>
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<PlotControls
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bind:show_controls
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bind:controls_open
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bind:x_axis
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bind:y2_axis
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bind:display
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{...rest}
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>
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{@render children?.({ orientation, x_axis, x2_axis, y_axis, y2_axis, display })}
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<SettingsSection
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title="Box / Violin"
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current_values={{ orientation, kind, side, whisker_mode, show_outliers, show_mean }}
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orientation = `vertical`
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kind = DEFAULTS.box.kind
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}}
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style="display: flex; flex-wrap: wrap; gap: 2ex"
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>
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Orientation:
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<select bind:value={orientation} id="{uid}-orientation">
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<option value="horizontal">Horizontal</option>
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</select>
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Glyph:
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<select bind:value={kind} id="{uid}-kind">
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<option value="violin+box">Violin + Box</option>
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</select>
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</label>
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{#if kind !== `box`}
|
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<label style="flex: 1">
|
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Violin side:
|
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<select bind:value={side} id="{uid}-side">
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<option value="both">Both</option>
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<option value="positive">Positive</option>
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<option value="negative">Negative</option>
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</select>
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</label>
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{/if}
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<label style="flex: 1">
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Whiskers:
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<select bind:value={whisker_mode} id="{uid}-whisker-mode">
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<option value="tukey">Tukey (1.5·IQR)</option>
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95
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+
<option value="minmax">Min/Max</option>
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96
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+
<option value="percentile">Percentile</option>
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<option value="std">Std Dev</option>
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</select>
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</label>
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<label style="flex: 1 1 100%">
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<input type="checkbox" bind:checked={show_outliers} />
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Show outliers
|
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</label>
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+
<label style="flex: 1 1 100%">
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<input type="checkbox" bind:checked={show_mean} />
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Show mean
|
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107
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+
</label>
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108
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+
</SettingsSection>
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|
+
</PlotControls>
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@@ -0,0 +1,19 @@
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1
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import type { Orientation, PlotConfig, ViolinKind, ViolinSide, WhiskerMode } from '..';
|
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2
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+
import type { PlotControlsProps } from '../core/types';
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3
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+
import type { Snippet } from 'svelte';
|
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type $$ComponentProps = Omit<PlotControlsProps, `children` | `post_children`> & {
|
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+
orientation?: Orientation;
|
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6
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+
whisker_mode?: WhiskerMode;
|
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7
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+
show_outliers?: boolean;
|
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8
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+
show_mean?: boolean;
|
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9
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kind?: ViolinKind;
|
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+
side?: ViolinSide;
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+
show_controls?: boolean;
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+
controls_open?: boolean;
|
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13
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+
children?: Snippet<[{
|
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14
|
+
orientation: Orientation;
|
|
15
|
+
} & Required<PlotConfig>]>;
|
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16
|
+
};
|
|
17
|
+
declare const BoxPlotControls: import("svelte").Component<$$ComponentProps, {}, "display" | "orientation" | "show_controls" | "x2_axis" | "y_axis" | "y2_axis" | "controls_open" | "x_axis" | "kind" | "side" | "whisker_mode" | "show_outliers" | "show_mean">;
|
|
18
|
+
type BoxPlotControls = ReturnType<typeof BoxPlotControls>;
|
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19
|
+
export default BoxPlotControls;
|
|
@@ -0,0 +1,14 @@
|
|
|
1
|
+
<script lang="ts">
|
|
2
|
+
// Thin wrapper around BoxPlot with violin defaults. A violin is the same chart as a box
|
|
3
|
+
// plot (per-series raw distribution on a categorical axis), so all the scaffolding is shared.
|
|
4
|
+
import type { ComponentProps } from 'svelte'
|
|
5
|
+
import BoxPlot from './BoxPlot.svelte'
|
|
6
|
+
|
|
7
|
+
let {
|
|
8
|
+
series = $bindable([]),
|
|
9
|
+
kind = $bindable(`violin`),
|
|
10
|
+
...rest
|
|
11
|
+
}: ComponentProps<typeof BoxPlot> = $props()
|
|
12
|
+
</script>
|
|
13
|
+
|
|
14
|
+
<BoxPlot bind:series bind:kind {...rest} />
|
|
@@ -0,0 +1,70 @@
|
|
|
1
|
+
declare const Violin: import("svelte").Component<import("svelte/elements").HTMLAttributes<HTMLDivElement> & import("..").BasePlotProps & import("..").PlotConfig & {
|
|
2
|
+
series?: import("./box-plot").BoxPlotSeries<Record<string, unknown>>[] | undefined;
|
|
3
|
+
orientation?: import("..").Orientation;
|
|
4
|
+
legend?: import("..").LegendConfig | null;
|
|
5
|
+
show_legend?: boolean;
|
|
6
|
+
box?: {
|
|
7
|
+
color?: string;
|
|
8
|
+
opacity?: number;
|
|
9
|
+
stroke_width?: number;
|
|
10
|
+
stroke_color?: string;
|
|
11
|
+
border_radius?: number;
|
|
12
|
+
} | undefined;
|
|
13
|
+
whisker?: {
|
|
14
|
+
width?: number;
|
|
15
|
+
color?: string;
|
|
16
|
+
cap_fraction?: number;
|
|
17
|
+
} | undefined;
|
|
18
|
+
median_style?: {
|
|
19
|
+
width?: number;
|
|
20
|
+
color?: string;
|
|
21
|
+
} | undefined;
|
|
22
|
+
outlier_style?: {
|
|
23
|
+
radius?: number;
|
|
24
|
+
opacity?: number;
|
|
25
|
+
stroke_width?: number;
|
|
26
|
+
} | undefined;
|
|
27
|
+
whisker_mode?: import("./box-plot").WhiskerMode;
|
|
28
|
+
whisker_range?: number;
|
|
29
|
+
whisker_percentiles?: import("../..").Vec2;
|
|
30
|
+
show_outliers?: boolean;
|
|
31
|
+
show_mean?: boolean;
|
|
32
|
+
show_value_labels?: boolean;
|
|
33
|
+
value_label_stat?: `median` | `mean`;
|
|
34
|
+
value_label_format?: string;
|
|
35
|
+
kind?: import("./box-plot").ViolinKind;
|
|
36
|
+
side?: import("./box-plot").ViolinSide;
|
|
37
|
+
bandwidth?: import("./box-plot").BandwidthOption;
|
|
38
|
+
violin_width?: number;
|
|
39
|
+
violin_style?: {
|
|
40
|
+
opacity?: number;
|
|
41
|
+
stroke_width?: number;
|
|
42
|
+
} | undefined;
|
|
43
|
+
kde_points?: number;
|
|
44
|
+
kde_cut?: number;
|
|
45
|
+
kde_max_samples?: number;
|
|
46
|
+
kde_clip?: [number | null, number | null];
|
|
47
|
+
tooltip?: import("svelte").Snippet<[import("./box-plot").BoxHandlerProps<Record<string, unknown>>]> | undefined;
|
|
48
|
+
user_content?: import("svelte").Snippet<[import("..").UserContentProps]>;
|
|
49
|
+
header_controls?: import("svelte").Snippet<[{
|
|
50
|
+
height: number;
|
|
51
|
+
width: number;
|
|
52
|
+
fullscreen: boolean;
|
|
53
|
+
}]> | undefined;
|
|
54
|
+
controls_extra?: import("svelte").Snippet<[{
|
|
55
|
+
orientation: import("..").Orientation;
|
|
56
|
+
} & Required<import("..").PlotConfig>]> | undefined;
|
|
57
|
+
change?: ((data: import("./box-plot").BoxHandlerProps<Record<string, unknown>> | null) => void) | undefined;
|
|
58
|
+
on_box_click?: ((data: import("./box-plot").BoxHandlerProps<Record<string, unknown>> & {
|
|
59
|
+
event: MouseEvent | KeyboardEvent;
|
|
60
|
+
}) => void) | undefined;
|
|
61
|
+
on_box_hover?: ((data: (import("./box-plot").BoxHandlerProps<Record<string, unknown>> & {
|
|
62
|
+
event: MouseEvent | FocusEvent | KeyboardEvent;
|
|
63
|
+
}) | null) => void) | undefined;
|
|
64
|
+
ref_lines?: import("..").RefLine[];
|
|
65
|
+
on_ref_line_click?: ((event: import("..").RefLineEvent) => void) | undefined;
|
|
66
|
+
on_ref_line_hover?: ((event: import("..").RefLineEvent | null) => void) | undefined;
|
|
67
|
+
pan?: import("..").PanConfig;
|
|
68
|
+
}, {}, "series" | "kind">;
|
|
69
|
+
type Violin = ReturnType<typeof Violin>;
|
|
70
|
+
export default Violin;
|
|
@@ -0,0 +1,56 @@
|
|
|
1
|
+
import type { Vec2 } from '../../math';
|
|
2
|
+
import type { HandlerProps } from '../core/types';
|
|
3
|
+
export type WhiskerMode = `tukey` | `minmax` | `percentile` | `std`;
|
|
4
|
+
export type ViolinKind = `box` | `violin` | `violin+box`;
|
|
5
|
+
export type ViolinSide = `both` | `positive` | `negative`;
|
|
6
|
+
export type BandwidthOption = number | `silverman` | `scott`;
|
|
7
|
+
export interface BoxPlotSeries<Metadata = Record<string, unknown>> {
|
|
8
|
+
id?: string | number;
|
|
9
|
+
y: readonly number[];
|
|
10
|
+
label?: string;
|
|
11
|
+
color?: string;
|
|
12
|
+
box_width?: number;
|
|
13
|
+
visible?: boolean;
|
|
14
|
+
legend_group?: string;
|
|
15
|
+
metadata?: Metadata;
|
|
16
|
+
x_axis?: `x1` | `x2`;
|
|
17
|
+
y_axis?: `y1` | `y2`;
|
|
18
|
+
whisker_mode?: WhiskerMode;
|
|
19
|
+
whisker_range?: number;
|
|
20
|
+
whisker_percentiles?: Vec2;
|
|
21
|
+
kind?: ViolinKind;
|
|
22
|
+
side?: ViolinSide;
|
|
23
|
+
bandwidth?: BandwidthOption;
|
|
24
|
+
violin_width?: number;
|
|
25
|
+
clip?: [number | null, number | null];
|
|
26
|
+
category?: string;
|
|
27
|
+
}
|
|
28
|
+
export interface BoxHandlerProps<Metadata = Record<string, unknown>> extends HandlerProps<Metadata> {
|
|
29
|
+
box_idx: number;
|
|
30
|
+
stats: BoxStats;
|
|
31
|
+
color: string;
|
|
32
|
+
category_label?: string;
|
|
33
|
+
active_y_axis: `y1` | `y2`;
|
|
34
|
+
active_x_axis: `x1` | `x2`;
|
|
35
|
+
}
|
|
36
|
+
export interface BoxStats {
|
|
37
|
+
min: number;
|
|
38
|
+
max: number;
|
|
39
|
+
q1: number;
|
|
40
|
+
median: number;
|
|
41
|
+
q3: number;
|
|
42
|
+
mean: number;
|
|
43
|
+
whisker_low: number;
|
|
44
|
+
whisker_high: number;
|
|
45
|
+
outliers: number[];
|
|
46
|
+
n: number;
|
|
47
|
+
}
|
|
48
|
+
export interface BoxStatsOptions {
|
|
49
|
+
whisker_mode?: WhiskerMode;
|
|
50
|
+
whisker_range?: number;
|
|
51
|
+
whisker_percentiles?: Vec2;
|
|
52
|
+
collect_outliers?: boolean;
|
|
53
|
+
}
|
|
54
|
+
export declare const WHISKER_MODES: readonly ["tukey", "minmax", "percentile", "std"];
|
|
55
|
+
export declare const is_whisker_mode: (val: string) => val is WhiskerMode;
|
|
56
|
+
export declare function compute_box_stats(values: readonly number[], opts?: BoxStatsOptions): BoxStats;
|
|
@@ -0,0 +1,129 @@
|
|
|
1
|
+
// Box plot statistics: compute quartiles, whiskers and outliers from a raw distribution.
|
|
2
|
+
// Single source of truth for the quantile math used by BoxPlot.svelte.
|
|
3
|
+
import { ascending } from 'd3-array';
|
|
4
|
+
import { quantile_unordered } from './quantile';
|
|
5
|
+
import { DEFAULTS } from '../../settings';
|
|
6
|
+
export const WHISKER_MODES = [`tukey`, `minmax`, `percentile`, `std`];
|
|
7
|
+
const WHISKER_MODE_SET = new Set(WHISKER_MODES);
|
|
8
|
+
export const is_whisker_mode = (val) => WHISKER_MODE_SET.has(val);
|
|
9
|
+
const EMPTY_STATS = {
|
|
10
|
+
min: NaN,
|
|
11
|
+
max: NaN,
|
|
12
|
+
q1: NaN,
|
|
13
|
+
median: NaN,
|
|
14
|
+
q3: NaN,
|
|
15
|
+
mean: NaN,
|
|
16
|
+
whisker_low: NaN,
|
|
17
|
+
whisker_high: NaN,
|
|
18
|
+
outliers: [],
|
|
19
|
+
n: 0,
|
|
20
|
+
};
|
|
21
|
+
const clamp01 = (val) => Math.max(0, Math.min(1, val));
|
|
22
|
+
function collect_outliers_by_scan(values, low_bound, high_bound, collect) {
|
|
23
|
+
if (!collect)
|
|
24
|
+
return [];
|
|
25
|
+
const outliers = [];
|
|
26
|
+
for (const val of values)
|
|
27
|
+
if (val < low_bound || val > high_bound)
|
|
28
|
+
outliers.push(val);
|
|
29
|
+
outliers.sort(ascending);
|
|
30
|
+
return outliers;
|
|
31
|
+
}
|
|
32
|
+
function tukey_scan(values, low_bound, high_bound, collect, data_min, data_max) {
|
|
33
|
+
let whisker_low = Infinity;
|
|
34
|
+
let whisker_high = -Infinity;
|
|
35
|
+
const outliers = [];
|
|
36
|
+
for (const val of values) {
|
|
37
|
+
if (val < low_bound || val > high_bound) {
|
|
38
|
+
if (collect)
|
|
39
|
+
outliers.push(val);
|
|
40
|
+
}
|
|
41
|
+
else {
|
|
42
|
+
if (val < whisker_low)
|
|
43
|
+
whisker_low = val;
|
|
44
|
+
if (val > whisker_high)
|
|
45
|
+
whisker_high = val;
|
|
46
|
+
}
|
|
47
|
+
}
|
|
48
|
+
if (collect)
|
|
49
|
+
outliers.sort(ascending);
|
|
50
|
+
return {
|
|
51
|
+
whisker_low: whisker_low === Infinity ? data_min : whisker_low,
|
|
52
|
+
whisker_high: whisker_high === -Infinity ? data_max : whisker_high,
|
|
53
|
+
outliers,
|
|
54
|
+
};
|
|
55
|
+
}
|
|
56
|
+
// Compute box plot statistics for a raw numeric distribution.
|
|
57
|
+
// Quartiles use type-7 linear interpolation, matching d3/numpy/pandas defaults.
|
|
58
|
+
// Non-finite values are filtered out; the input array is never mutated.
|
|
59
|
+
export function compute_box_stats(values, opts = {}) {
|
|
60
|
+
const {
|
|
61
|
+
// Fallback derives from DEFAULTS.box so component and helper defaults can't drift
|
|
62
|
+
whisker_mode = DEFAULTS.box.whisker_mode, whisker_range = 1.5, whisker_percentiles = [5, 95], collect_outliers = true, } = opts;
|
|
63
|
+
const vals = values.filter((val) => Number.isFinite(val));
|
|
64
|
+
const n_vals = vals.length;
|
|
65
|
+
if (n_vals === 0)
|
|
66
|
+
return { ...EMPTY_STATS, outliers: [] };
|
|
67
|
+
let sum = 0;
|
|
68
|
+
let data_min = Infinity;
|
|
69
|
+
let data_max = -Infinity;
|
|
70
|
+
for (const val of vals) {
|
|
71
|
+
sum += val;
|
|
72
|
+
if (val < data_min)
|
|
73
|
+
data_min = val;
|
|
74
|
+
if (val > data_max)
|
|
75
|
+
data_max = val;
|
|
76
|
+
}
|
|
77
|
+
const mean = sum / n_vals;
|
|
78
|
+
const qtl = (prob) => quantile_unordered(vals, prob);
|
|
79
|
+
const collect_beyond = (lo, hi) => collect_outliers_by_scan(vals, lo, hi, collect_outliers);
|
|
80
|
+
const q1 = qtl(0.25);
|
|
81
|
+
const median = qtl(0.5);
|
|
82
|
+
const q3 = qtl(0.75);
|
|
83
|
+
let whisker_low;
|
|
84
|
+
let whisker_high;
|
|
85
|
+
let outliers = [];
|
|
86
|
+
if (whisker_mode === `minmax`) {
|
|
87
|
+
whisker_low = data_min;
|
|
88
|
+
whisker_high = data_max;
|
|
89
|
+
}
|
|
90
|
+
else if (whisker_mode === `percentile`) {
|
|
91
|
+
// Order-defensively so reversed input like [95, 5] still yields low <= high
|
|
92
|
+
const pct_low = Math.min(...whisker_percentiles);
|
|
93
|
+
const pct_high = Math.max(...whisker_percentiles);
|
|
94
|
+
whisker_low = qtl(clamp01(pct_low / 100));
|
|
95
|
+
whisker_high = qtl(clamp01(pct_high / 100));
|
|
96
|
+
outliers = collect_beyond(whisker_low, whisker_high);
|
|
97
|
+
}
|
|
98
|
+
else if (whisker_mode === `std`) {
|
|
99
|
+
let variance_sum = 0;
|
|
100
|
+
for (const val of vals) {
|
|
101
|
+
const delta = val - mean;
|
|
102
|
+
variance_sum += delta * delta;
|
|
103
|
+
}
|
|
104
|
+
const std = n_vals > 1 ? Math.sqrt(variance_sum / (n_vals - 1)) : 0;
|
|
105
|
+
const low_bound = mean - whisker_range * std;
|
|
106
|
+
const high_bound = mean + whisker_range * std;
|
|
107
|
+
// Clamp whisker ends to the data extent so they never extend past real values
|
|
108
|
+
whisker_low = Math.max(data_min, low_bound);
|
|
109
|
+
whisker_high = Math.min(data_max, high_bound);
|
|
110
|
+
outliers = collect_beyond(low_bound, high_bound);
|
|
111
|
+
}
|
|
112
|
+
else {
|
|
113
|
+
// tukey (default): whiskers extend to the most extreme datum within range*IQR of the quartiles
|
|
114
|
+
const iqr = q3 - q1;
|
|
115
|
+
({ whisker_low, whisker_high, outliers } = tukey_scan(vals, q1 - whisker_range * iqr, q3 + whisker_range * iqr, collect_outliers, data_min, data_max));
|
|
116
|
+
}
|
|
117
|
+
return {
|
|
118
|
+
min: data_min,
|
|
119
|
+
max: data_max,
|
|
120
|
+
q1,
|
|
121
|
+
median,
|
|
122
|
+
q3,
|
|
123
|
+
mean,
|
|
124
|
+
whisker_low,
|
|
125
|
+
whisker_high,
|
|
126
|
+
outliers,
|
|
127
|
+
n: n_vals,
|
|
128
|
+
};
|
|
129
|
+
}
|
|
@@ -0,0 +1,17 @@
|
|
|
1
|
+
import type { Vec2 } from '../../math';
|
|
2
|
+
export interface KdeResult {
|
|
3
|
+
grid: number[];
|
|
4
|
+
density: number[];
|
|
5
|
+
bandwidth: number;
|
|
6
|
+
}
|
|
7
|
+
export interface KdeOptions {
|
|
8
|
+
bandwidth?: number | `silverman` | `scott`;
|
|
9
|
+
n_points?: number;
|
|
10
|
+
cut?: number;
|
|
11
|
+
clip?: [number | null, number | null];
|
|
12
|
+
range?: Vec2;
|
|
13
|
+
max_samples?: number;
|
|
14
|
+
}
|
|
15
|
+
export declare function silverman_bandwidth(sorted: readonly number[]): number;
|
|
16
|
+
export declare function scott_bandwidth(samples: readonly number[]): number;
|
|
17
|
+
export declare function gaussian_kde(samples: readonly number[], opts?: KdeOptions): KdeResult;
|