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molstar

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A comprehensive macromolecular library.

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"use strict"; /** * Copyright (c) 2019-2020 mol* contributors, licensed under MIT, See LICENSE file for more info. * * @author Alexander Rose <alexander.rose@weirdbyte.de> */ Object.defineProperty(exports, "__esModule", { value: true }); exports.calcUnitProteinTraceLookup3D = calcUnitProteinTraceLookup3D; const geometry_1 = require("../../../../mol-math/geometry"); const int_1 = require("../../../../mol-data/int"); const boundary_1 = require("../../../../mol-math/geometry/boundary"); function calcUnitProteinTraceLookup3D(unit, unitProteinResidues) { const { x, y, z } = unit.model.atomicConformation; const { traceElementIndex } = unit.model.atomicHierarchy.derived.residue; const indices = new Uint32Array(unitProteinResidues.length); for (let i = 0, il = unitProteinResidues.length; i < il; ++i) { indices[i] = traceElementIndex[unitProteinResidues[i]]; } const position = { x, y, z, indices: int_1.SortedArray.ofSortedArray(indices) }; return (0, geometry_1.GridLookup3D)(position, (0, boundary_1.getBoundary)(position)); }