molmoda / data /src /TreeNodes /TreeNodeList /TreeNodeList.ts
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import type { FileInfo } from "@/FileSystem/FileInfo";
import { _convertTreeNodeList } from "@/FileSystem/LoadSaveMolModels/ConvertMolModels/_ConvertTreeNodeList";
import { parseAndLoadMoleculeFile } from "@/FileSystem/LoadSaveMolModels/ParseMolModels/ParseMoleculeFiles";
import { ILoadMolParams } from "@/FileSystem/LoadSaveMolModels/ParseMolModels/Types";
import { getFormatInfoGivenType } from "@/FileSystem/LoadSaveMolModels/Types/MolFormats";
import { messagesApi } from "@/Api/Messages";
import type { ITreeNode, TreeNode } from "../TreeNode/TreeNode";
import { TreeNodeListCopies } from "./_Copy";
import { EasyCriterion, TreeNodeListFilters } from "./_Filters";
import { TreeNodeListNodeActions } from "./_NodeActions";
import { randomID } from "@/Core/Utils/MiscUtils";
/**
* TreeNodeList class
*/
export class TreeNodeList {
public _nodes: TreeNode[] = [];
private _filters: TreeNodeListFilters;
private _nodeActions: TreeNodeListNodeActions;
private _copy: TreeNodeListCopies;
public triggerId = ""; // Purpose of this is just to trigger reactivity if needed
// This is to keep track of titles. It takes a surprisingly long time to
// generate this set on the fly.
// private _titles: Set<string> = new Set<string>();
/**
* Constructor.
*
* @param {TreeNode[]} [nodes] The nodes to add to the list.
*/
constructor(nodes?: TreeNode[]) {
if (nodes) {
this._nodes = nodes;
// this._updateTitles();
}
this._filters = new TreeNodeListFilters(this);
this._nodeActions = new TreeNodeListNodeActions(this);
this._copy = new TreeNodeListCopies(this);
// For chaining
return this;
}
/**
* Triggers reactivity. This is useful on rare occasions you need to trigger
* reactivity explicitly. Tested on the main, root node. May work on others.
*/
public triggerReactivity() {
this.triggerId = randomID();
this.nodes = this.nodes.map((n) => n);
for (const node of this.nodes) {
node.triggerReactivity();
node.nodes?.triggerReactivity();
}
}
// private _updateTitles(): void {
// this._titles = new Set<string>();
// this._nodes.forEach((node) => {
// this._titles.add(node.title);
// });
// }
/**
* Gets the filters.
*
* @returns {TreeNodeListFilters} The filters.
*/
public get filters(): TreeNodeListFilters {
return this._filters;
}
/**
* Gets the copy actions.
*
* @returns {TreeNodeListCopies} The copy actions.
*/
public get copy(): TreeNodeListCopies {
return this._copy;
}
/**
* Gets the nodes as an array.
*
* @returns {TreeNode[]} The nodes.
*/
public get nodes(): TreeNode[] {
return this._nodes;
}
/**
* Sets the nodes.
*
* @param {TreeNode[]} nodes The nodes.
*/
public set nodes(nodes: TreeNode[]) {
this._nodes = nodes;
// this._updateTitles();
}
/**
* An easy way to look up nodes in the descendency. Can be a list of
* criteria (one criteria per level) or a single criteria.
*
* @param {EasyCriterion[]|EasyCriterion} searchCriteria The criteria.
* @returns {TreeNodeList} The nodes that match the criteria.
*/
public lookup(
searchCriteria: EasyCriterion[] | EasyCriterion
): TreeNodeList {
return this._filters.lookup(searchCriteria);
}
/**
* Add a node to the list.
*
* @param {TreeNode} node The node to add.
*/
public push(node: TreeNode) {
// let newTitle = node.title;
// if (this._titles.size > 0) {
// // Does node.title already exist in this list? If so, rename it.
// let idx = 0;
// while (this._titles.has(newTitle)) {
// newTitle = node.title + " (" + ++idx + ")";
// }
// this._titles.add(newTitle);
// }
// node.title = newTitle;
// // Throw warning if title already exists.
// const titles = this._nodes.map((n) => n.title);
// console.log("titles", titles);
// // If the title already exists, throw warning.
// if (titles.includes(node.title)) {
// const msg =
// "Warning: Node with title " +
// node.title +
// " already exists. When adding nodes, try to make them unique to avoid problems in the data panel!";
// // if (GlobalVars.isLocalHost) {
// // alert(msg);
// // }
// console.warn(msg);
// }
this._nodes.push(node);
}
/**
* Gets the number of nodes in this list.
*
* @returns {number} The number of nodes.
*/
public get length(): number {
return this._nodes.length;
}
/**
* Gets the node at the specified index.
*
* @param {number} index The index.
* @returns {TreeNode} The node.
*/
public get(index: number): TreeNode {
return this._nodes[index];
}
/**
* Sets the node at the specified index.
*
* @param {number} index The index.
* @param {TreeNode} node The node.
*/
public set(index: number, node: TreeNode) {
this._nodes[index] = node;
}
/**
* Iterates through the nodes.
*
* @param {Function} func The function to call for each node.
*/
public forEach(func: (node: TreeNode, index: number) => void) {
for (let i = 0; i < this._nodes.length; i++) {
func(this._nodes[i], i);
}
}
/**
* Filters the nodes.
*
* @param {Function} func The function to call for each node. If the
* function returns true, the node is included in
* the result.
* @returns {TreeNodeList} The filtered nodes.
*/
public filter(
func: (node: TreeNode, index: number, array: any) => boolean
): TreeNodeList {
return new TreeNodeList(this._nodes.filter(func));
}
/**
* Gets the first node in the list that matches the specified criteria.
*
* @param {Function} func The function to call for each node. If the
* function returns true, the node is included in
* the result.
* @returns {TreeNode|undefined} The first node that matches the criteria,
* or undefined if no nodes match the criteria.
*/
public find(
func: (node: TreeNode, index?: number, array?: any) => boolean
): TreeNode | undefined {
return this._nodes.find(func);
}
/**
* Maps the nodes to a new array.
*
* @param {Function} func The function to call for each node. The function
* should return the new value for the node.
* @returns {any[]} The mapped values.
*/
public map(
func: (node: TreeNode, index?: number, array?: any) => any
): any[] {
return this._nodes.map(func);
}
/**
* Removes the first node in the list and returns it.
*
* @returns {TreeNode|undefined} The node that was removed, or undefined if
* the list is empty.
*/
public shift(): TreeNode | undefined {
// const firstElement = this._nodes.shift();
// if (firstElement !== undefined) {
// this._titles.delete(firstElement.title);
// }
return this._nodes.shift();
}
/**
* Inserts new elements at the start of the list, and returns the new length
* of the list.
*
* @param {TreeNode} node The node to insert.
* @returns {number} The new length of the list.
*/
public unshift(node: TreeNode): number {
// this._titles.add(node.title);
return this._nodes.unshift(node);
}
/**
* Removes the last element from the list and returns it. If the list is
* empty, undefined is returned and the list is not modified.
*
* @returns {TreeNode|undefined} The node that was removed, or undefined if
* the list is empty.
*/
public pop(): TreeNode | undefined {
// const lastElement = this._nodes.pop();
// if (lastElement !== undefined) {
// this._titles.delete(lastElement.title);
// }
return this._nodes.pop();
}
/**
* Adds all the nodes in the specified list to this list. Acts in place, but
* also returns this list for chaining.
*
* @param {TreeNodeList} nodeList The list of nodes to add.
* @returns {TreeNodeList} This list.
*/
public extend(nodeList: TreeNodeList): TreeNodeList {
nodeList.forEach((node: TreeNode) => {
this.push(node);
});
return this;
}
/**
* Calls the specified callback function for all the elements in the list.
* The return value of the callback function is the accumulated result, and
* is provided as an argument in the next call to the callback function.
*
* @param {Function} func The function to call for each node.
* The function should return the new
* value for the accumulator.
* @param {any} [initialValue] The initial value for the accumulator.
* @returns {any} The accumulated result.
*/
public reduce(
func: (
accumulator: any,
node: TreeNode,
index?: number,
array?: any
) => any,
initialValue?: any
): any {
return this._nodes.reduce(func, initialValue);
}
/**
* Tests whether at least one element in the list passes the test
* implemented by the provided function.
*
* @param {Function} func The function to test for each element.
* @returns {boolean} `true` if the callback function returns a truthy
* value for at least one element in the list. Otherwise, `false`.
*/
public some(
func: (node: TreeNode, index?: number, array?: TreeNode[]) => boolean
): boolean {
return this._nodes.some(func);
}
/**
* Sorts the nodes.
*
* @param {Function} func The function to call for each node. The function
* should return a number indicating the sort order.
* @returns {TreeNodeList} This list, sorted (for chaining).
*/
public sort(func: (a: TreeNode, b: TreeNode) => number): TreeNodeList {
this._nodes.sort(func);
return this;
}
/**
* Gets the nodes as an array.
*
* @returns {TreeNode[]} The nodes.
*/
public toArray(): TreeNode[] {
return this._nodes;
}
/**
* Gets the nodes as a serialized array of ITreeNode interfaces. Good for
* saving to JSON or passing to webworker.
*
* @returns {ITreeNode[]} The serialized nodes.
*/
public serialize(): ITreeNode[] {
return this._nodes.map((node: TreeNode) => {
return node.serialize();
});
}
/**
* Clears the list of nodes.
*/
public clear() {
this._nodes = [];
// this._titles.clear();
}
/**
* Loads a molecule into the list.
*
* @deprecated Use `parseAndLoadMoleculeFile` from `FileSystem` instead.
* @param {ILoadMolParams} params The parameters for loading the molecule.
* @returns {Promise<void | TreeNodeList>} A promise that resolves with the
* list of new nodes, or undefined on failure.
*/
public async loadFromFileInfo(
params: ILoadMolParams
): Promise<void | TreeNodeList> {
return parseAndLoadMoleculeFile(params);
}
/**
* Remove a node of given id, as well as any childless nodes that result.
* In-place operation.
*
* @param {string | TreeNode | null} node The id of the node to remove, or
* the node itself.
*/
public removeNode(node: string | TreeNode | null) {
// if (typeof node === "string") {
// // If it's a string
// this._titles.delete(node);
// } else if (node) {
// // It's a TreeNode
// this._titles.delete(node.title);
// }
this._nodeActions.remove(node);
}
/**
* Gets all the nodes, whether terminal or not.
*
* @returns {TreeNodeList} The flat array of all nodes.
*/
public get flattened(): TreeNodeList {
return this._nodeActions.flattened;
}
/**
* An alias for filters.onlyTerminal. Gets all the terminal nodes. You
* access this offten enough that it's easier to add this alias.
*
* @returns {TreeNodeList} All the terminal nodes.
*/
public get terminals(): TreeNodeList {
return this._filters.onlyTerminal;
}
/**
* Convert this TreeNodeList to a specified molecular format.
*
* @param {string} targetExt The extension of the format to
* convert to.
* @param {boolean} [merge=true] Whether to merge the models into
* a single PDB string.
* @returns {FileInfo[]} The text-formatted (e.g., PDB, MOL2) strings.
*/
public async toFileInfos(
targetExt: string,
merge = true
): Promise<FileInfo[]> {
// Determine if in worker
const inWorker =
// eslint-disable-next-line @typescript-eslint/ban-ts-comment
// @ts-ignore
typeof WorkerGlobalScope !== "undefined" &&
// eslint-disable-next-line @typescript-eslint/ban-ts-comment
// @ts-ignore
self instanceof WorkerGlobalScope;
const formatInfo = getFormatInfoGivenType(targetExt);
// Start spinner
let spinnerId: any;
if (!inWorker) {
spinnerId = messagesApi.startWaitSpinner();
}
const fileInfos = await _convertTreeNodeList(this, targetExt, merge);
// Update the molecule name in the fileInfo contents
for (let i = 0; i < fileInfos.length; i++) {
if (formatInfo && formatInfo.updateMolNameInContents) {
fileInfos[i].contents = formatInfo.updateMolNameInContents(
fileInfos[i].contents,
this._nodes[i].title
);
}
}
if (!inWorker) {
messagesApi.stopWaitSpinner(spinnerId);
}
return fileInfos;
}
/**
* A helper function tht adds all the nodes in this list to the molecules in
* the vuex store.
*
* @param {string | null} tag The tag to add to the main tree.
* @param {boolean} [reassignIds=true] Whether to reassign IDs to the new
* nodes to avoid collisions. Set to false
* when loading a saved session.
* @param {boolean} [terminalNodeTitleRevisable=true] Whether the title of
* the terminal node
* should be revisable.
* Revised if there is
* only one terminal
* node. If you're adding
* nodes incrementally,
* good to set to false.
* @param {boolean} [resetVisibilityAndSelection=true] Whether to make the molecule
* visible and unselected. Set to false
* when loading a saved session where these
* properties should be preserved.
*/
public addToMainTree(
tag: string | null,
reassignIds = true,
terminalNodeTitleRevisable = true,
resetVisibilityAndSelection = true
) {
for (const node of this._nodes) {
node.addToMainTree(
tag,
reassignIds,
terminalNodeTitleRevisable,
resetVisibilityAndSelection
);
}
}
/**
* A helper function that creates a new TreeNodeList. This is useful for
* avoiding circular dependencies.
*
* @param {TreeNode[]} [nodes=[]] The nodes to add to the new list.
* @returns {TreeNodeList} The new list.
*/
public newTreeNodeList(nodes: TreeNode[] = []): TreeNodeList {
// To avoid circular dependencies
return new TreeNodeList(nodes);
}
/**
* Merges all the nodes in this list into a single node. This is useful for
* converting a list of molecules into a single molecule.
*
* @param {string} [topLevelTitle=undefined] The title of the top-level
* node. If undefined, the title
* of the first node is used.
* @returns {TreeNodeList} The new list.
*/
public merge(topLevelTitle?: string): TreeNodeList {
// This is where the title is being set to first item. Bad if multiple
// frames!
const firstNode = this._nodes[0].shallowCopy();
if (topLevelTitle) {
firstNode.title = topLevelTitle;
}
for (let i = 1; i < this._nodes.length; i++) {
const node = this._nodes[i];
firstNode.mergeInto(node);
}
return new TreeNodeList([firstNode]);
}
}