Compare commits
11 Commits
73394e562d
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8b6d07fb3d
Author | SHA1 | Date | |
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8b6d07fb3d | |||
de603d405f | |||
118a669371 | |||
74a69cf8f7 | |||
e12fed0489 | |||
33e34e9fde | |||
7c3aa27c71 | |||
4e63a46dc6 | |||
f1b3c7628c | |||
0c4b59e577 | |||
a6cf8340bf |
8
Assets/script.meta
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8
Assets/script.meta
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fileFormatVersion: 2
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guid: 7f609c39b51d9e447a6a4a5964011b44
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9
Assets/script/Atom.cs
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9
Assets/script/Atom.cs
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[System.Serializable]
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public class Atom
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{
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// nom de l'atom
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public string element;
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// coordonée XYZ
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public float[] geometry;
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}
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11
Assets/script/Atom.cs.meta
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11
Assets/script/Atom.cs.meta
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9
Assets/script/Bond.cs
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9
Assets/script/Bond.cs
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[System.Serializable]
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public class Bond
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{
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// numéro des atome lier
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public int[] atoms;
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// nombre de liaison
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public int order;
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}
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11
Assets/script/Bond.cs.meta
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11
Assets/script/Bond.cs.meta
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98
Assets/script/Molecul.json
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98
Assets/script/Molecul.json
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{
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"molecules":[
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{
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"name": "Dioxygène",
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"formula": "O2",
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"atoms": [
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{
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"element": "O",
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"geometry": [0.0, 0.0, 0.0]
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},
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{
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"element": "O",
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"geometry": [1.2, 0.0, 0.0]
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}
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],
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"bonds": [
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{"atoms": [0, 1], "order": 2}
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],
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"properties": {
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"molecularMass": 32.0,
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"meltingPoint": -218.8,
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"boilingPoint": -183.0
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}
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},
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{
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"name": "Ozone",
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"formula": "O3",
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"atoms": [
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{"element": "O", "geometry": [0.0, 0.0, 0.0]},
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{"element": "O", "geometry": [0.7, 0.0, 0.0]},
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{"element": "O", "geometry": [1.4, 0.0, 0.0]}
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],
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"bonds": [
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{"atoms": [0, 1], "order": 1},
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{"atoms": [1, 2], "order": 1}
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],
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"properties": {
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"molecularMass": 47.9982,
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"meltingPoint": -192.5,
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"boilingPoint": -110.0
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}
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},
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{
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"name": "Dioxyde de carbone",
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"formula": "CO2",
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"atoms": [
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{"element": "C", "geometry": [0.0, 0.0, 0.0]},
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{"element": "O", "geometry": [1.2, 0.0, 0.0]},
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{"element": "O", "geometry": [-1.2, 0.0, 0.0]}
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],
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"bonds": [
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{"atoms": [0, 1], "order": 2},
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{"atoms": [0, 2], "order": 2}
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],
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"properties": {
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"molecularMass": 44.0095,
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"meltingPoint": -56.6,
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"boilingPoint": -78.5
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}
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},
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{
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"name": "Butane",
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"formula": "C4H10",
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"atoms": [
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{"element": "C", "geometry": [0.0, 0.0, 0.0]},
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{"element": "C", "geometry": [1.5, 0.0, 0.0]},
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{"element": "C", "geometry": [3.0, 0.0, 0.0]},
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{"element": "C", "geometry": [4.5, 0.0, 0.0]},
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{"element": "H", "geometry": [0.0, 1.5, 0.0]},
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{"element": "H", "geometry": [0.0, -1.5, 0.0]},
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{"element": "H", "geometry": [1.5, 1.5, 0.0]},
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{"element": "H", "geometry": [1.5, -1.5, 0.0]},
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{"element": "H", "geometry": [3.0, 1.5, 0.0]},
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{"element": "H", "geometry": [3.0, -1.5, 0.0]},
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{"element": "H", "geometry": [4.5, 1.5, 0.0]},
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{"element": "H", "geometry": [4.5, -1.5, 0.0]}
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],
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"bonds": [
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{"atoms": [0, 1], "order": 1},
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{"atoms": [1, 2], "order": 1},
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{"atoms": [2, 3], "order": 1},
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{"atoms": [0, 4], "order": 1},
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{"atoms": [0, 5], "order": 1},
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{"atoms": [1, 6], "order": 1},
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{"atoms": [1, 7], "order": 1},
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{"atoms": [2, 8], "order": 1},
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{"atoms": [2, 9], "order": 1},
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{"atoms": [3, 10], "order": 1},
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{"atoms": [3, 11], "order": 1}
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],
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"properties": {
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"molecularMass": 58.1222,
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"meltingPoint": -138.3,
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"boilingPoint": -0.5
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}
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}
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]
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}
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7
Assets/script/Molecul.json.meta
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7
Assets/script/Molecul.json.meta
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@ -0,0 +1,7 @@
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fileFormatVersion: 2
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guid: 3a11d0f923ae50c4d82ee1dda0f629a3
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TextScriptImporter:
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59
Assets/script/MoleculeFactory.cs
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59
Assets/script/MoleculeFactory.cs
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@ -0,0 +1,59 @@
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using System;
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using System.Collections.Generic;
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using UnityEngine;
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public class MoleculeFactory : MonoBehaviour{
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public TextAsset jsonFile;
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private static MoleculeFactory instance;
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private Molecules moleculesInJson;
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private Dictionary<string, Molecule> moleculesDictionary;
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public MoleculeFactory(TextAsset jsonFile){
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MoleculeFactory.instance = this;
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moleculesDictionary = new Dictionary<string, Molecule>();
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moleculesInJson = JsonUtility.FromJson<Molecules>(jsonFile.text);
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foreach (var molecule in moleculesInJson.molecules){
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moleculesDictionary.Add(molecule.formula, molecule);
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}
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}
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public static MoleculeFactory getInstrance(){
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if(MoleculeFactory.instance == null){
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Debug.LogError("no Json file");
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}
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return MoleculeFactory.instance;
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}
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public static MoleculeFactory getInstrance(TextAsset jsonFile){
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if(MoleculeFactory.instance == null){
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MoleculeFactory.instance = new MoleculeFactory(jsonFile);
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}
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return MoleculeFactory.instance;
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}
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public GameObject createMolecule (string formula){
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if(!moleculesDictionary.ContainsKey(formula)){
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Debug.LogError("molecules does not existe in json");
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}
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Molecule molecule = moleculesDictionary[formula];
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GameObject sortie = new GameObject(molecule.name);
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foreach (Atom atom in molecule.atoms) {
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GameObject sphere = GameObject.CreatePrimitive(PrimitiveType.Sphere);
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sphere.transform.parent = sortie.transform;
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sphere.name = atom.element;
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sphere.transform.localPosition = new Vector3(atom.geometry[0], atom.geometry[1], atom.geometry[2]);
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//TODO: géré les laision
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//TODO: géré la taille de l'atome
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//TODO: géré la couleur de l'atome
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}
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return sortie;
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}
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}
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11
Assets/script/MoleculeFactory.cs.meta
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11
Assets/script/MoleculeFactory.cs.meta
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@ -0,0 +1,11 @@
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27
Assets/script/Molecules.cs
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27
Assets/script/Molecules.cs
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@ -0,0 +1,27 @@
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using System.Collections.Generic;
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using System;
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[System.Serializable]
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public class Molecule
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{
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// nom molécules
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public string name;
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// formule melécule
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public string formula;
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// liste des atoms
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public Atom[] atoms;
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// liste des liason entre les atoms
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public Bond[] bonds;
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// prorpiété de la molécule
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public Properties properties;
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}
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[System.Serializable]
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public class Molecules
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{
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// liste des liason entre les atoms
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public Molecule[] molecules;
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}
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11
Assets/script/Molecules.cs.meta
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11
Assets/script/Molecules.cs.meta
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@ -0,0 +1,11 @@
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10
Assets/script/Properties.cs
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10
Assets/script/Properties.cs
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@ -0,0 +1,10 @@
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[System.Serializable]
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public class Properties
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{
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// masse en g/mol
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public float molecularMass;
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// température de fusion (solid->liquide)
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public float meltingPoint;
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// température d'évaporation (liquide-> gaz)
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public float boilingPoint;
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}
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11
Assets/script/Properties.cs.meta
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11
Assets/script/Properties.cs.meta
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34
Assets/script/ReadMolecule.cs
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34
Assets/script/ReadMolecule.cs
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@ -0,0 +1,34 @@
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using System.Collections;
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using System.Collections.Generic;
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using UnityEngine;
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public class ReadMolecule : MonoBehaviour
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{
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public TextAsset jsonFile;
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void Start(){
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Molecules moleculesInJson = JsonUtility.FromJson<Molecules>(jsonFile.text);
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int molNum = 0;
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int dist = 5;
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foreach (Molecule molecule in moleculesInJson.molecules){
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GameObject moleculeObj = new GameObject(molecule.name);
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foreach (Atom atom in molecule.atoms){
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GameObject sphere = GameObject.CreatePrimitive(PrimitiveType.Sphere);
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sphere.transform.parent = moleculeObj.transform;
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sphere.name = atom.element;
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sphere.transform.localPosition = new Vector3(atom.geometry[0], atom.geometry[1], atom.geometry[2]);
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}
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moleculeObj.transform.position = new Vector3(molNum*dist,0,0);
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molNum++;
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}
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}
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// Update is called once per frame
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void Update()
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{
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}
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}
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11
Assets/script/ReadMolecule.cs.meta
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1
QCAR/somedata16
Normal file
1
QCAR/somedata16
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@ -0,0 +1 @@
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AAABmYLL8/oCWYDVnt66QIDwPq6z4DN6r3/58aZWC0zcxYa43TCnvCp9IGuXZLgAObCqIm1fhMsWLttc6QAE6obPbuzCjEssQlT41wW38sIVuVhmsw6vfjVsXAQG/GQOgamARLtOkhTKi309FNa+3akhJu9wuEv5jF3vfRbPBoeMCWZuk4Pr8aP7mPH8+10geWHoSWbxgsaEEgrE0yO2xoQwTy2XOmCzZytqk+moWXU7VBu+0//q+koDSnWbjOkEGUfRwMmBJIK9J5TDJrSf/QZYBcEx1daR47cicuXzCb81VtaSvU5VIb9anoX6fukOHe/nCAfsltXFn+4G24NKlejZ568=
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