/* * Jalview - A Sequence Alignment Editor and Viewer (Version 2.6) * Copyright (C) 2010 J Procter, AM Waterhouse, G Barton, M Clamp, S Searle * * This file is part of Jalview. * * Jalview is free software: you can redistribute it and/or * modify it under the terms of the GNU General Public License * as published by the Free Software Foundation, either version 3 of the License, or (at your option) any later version. * * Jalview is distributed in the hope that it will be useful, but * WITHOUT ANY WARRANTY; without even the implied warranty * of MERCHANTABILITY or FITNESS FOR A PARTICULAR * PURPOSE. See the GNU General Public License for more details. * * You should have received a copy of the GNU General Public License along with Jalview. If not, see . */ package MCview; import java.awt.*; public class Atom { public float x; public float y; public float z; public int number; public String name; public String resName; public int resNumber; public char insCode = ' '; public String resNumIns = null; public int type; Color color = Color.lightGray; public String chain; public int alignmentMapping = -1; public int atomIndex; public float occupancy = 0; public float tfactor = 0; public boolean isSelected = false; public Atom(String str) { atomIndex = Integer.parseInt(str.substring(6, 11).trim()); name = str.substring(12, 15).trim(); resName = str.substring(17, 20); chain = str.substring(21, 22); resNumber = Integer.parseInt(str.substring(22, 26).trim()); resNumIns = str.substring(22, 27); insCode = str.substring(26, 27).charAt(0); this.x = (float) (new Float(str.substring(30, 38).trim()).floatValue()); this.y = (float) (new Float(str.substring(38, 46).trim()).floatValue()); this.z = (float) (new Float(str.substring(47, 55).trim()).floatValue()); occupancy = (float) (new Float(str.substring(54, 60).trim()) .floatValue()); tfactor = (float) (new Float(str.substring(60, 66).trim()).floatValue()); } public Atom(float x, float y, float z) { this.x = x; this.y = y; this.z = z; } // public void setColor(Color col) { // this.color = col; // } }