00001 // -*- mode: c++; -*- 00002 // 00003 //The Biomolecule Toolkit (BTK) is a C++ library for use in the 00004 //modeling, analysis, and design of biological macromolecules. 00005 //Copyright (C) 2001, Eric Alm <ealm3141@users.sourceforge.net> 00006 // 00007 //This program is free software; you can redistribute it and/or modify 00008 //it under the terms of the GNU Lesser General Public License as published 00009 //by the Free Software Foundation; either version 2.1 of the License, or (at 00010 //your option) any later version. 00011 // 00012 //This program is distributed in the hope that it will be useful, but 00013 //WITHOUT ANY WARRANTY; without even the implied warranty of 00014 //MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU 00015 //Lesser General Public License for more details. 00016 // 00017 //You should have received a copy of the GNU Lesser General Public License 00018 //along with this program; if not, write to the Free Software Foundation, 00019 //Inc., 59 Temple Place - Suite 330, Boston, MA 02111-1307, USA. 00020 00021 /* sasa_lut.h */ 00022 00023 #ifndef SASA_LUT_H_ 00024 #define SASA_LUT_H_ 00025 00026 namespace BTK_Internal { 00027 00028 const int WORDSIZE = sizeof(unsigned long); 00029 00031 const int MASK_SIZE = 162; 00032 00034 const int MASK_BYTES = (MASK_SIZE-1)/8 + 1; 00035 00037 const int MASK_BITS = MASK_BYTES*8; 00038 00040 const int MASK_WORDS = (MASK_BYTES-1)/WORDSIZE + 1; 00041 00043 const int D2_NUM = 100; 00044 const int NUMPHI = 64; 00045 const int NUMTHETA = 64; 00046 00047 00049 // final wordsize is added so that we can safely 00050 // read word-sized chunks from the mask array 00051 extern const unsigned char sasa_mask_lut[MASK_SIZE*D2_NUM*MASK_BYTES+WORDSIZE]; 00052 extern const unsigned char sasa_angle_lut[NUMPHI*NUMTHETA]; 00053 00054 } 00055 00056 #endif 00057 00058
1.3.6