/dports/science/openbabel/openbabel-3.1.1/test/pdb_ligands_sdf/ |
H A D | 5t2y_753.sdf | 3 Coordinates from PDB:5T2Y:A:201 Model:1 without hydrogens 107 5T2Y
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/dports/math/fftw3/fftw-3.3.9/rdft/scalar/r2cf/ |
H A D | hc2cf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hc2cf_16() local 286 T2Y = T2U + T2X; in hc2cf_16() 307 Rm[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hc2cf_16() 308 Rp[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hc2cf_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hc2cf_16() local 760 T2Y = T2V - T2Q; in hc2cf_16() 778 Im[WS(rs, 3)] = T2X - T2Y; in hc2cf_16() 780 Ip[WS(rs, 4)] = T2X + T2Y; in hc2cf_16()
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H A D | hf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hf_16() local 286 T2Y = T2U - T2X; in hf_16() 307 ci[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hf_16() 308 cr[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hf_16() 684 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hf_16() local 694 T2Y = T2V - T2Q; in hf_16() 708 cr[WS(rs, 12)] = T2X - T2Y; in hf_16() 709 ci[WS(rs, 11)] = T2X + T2Y; in hf_16()
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H A D | hc2cf2_16.c | 355 E T2Y, T2Z, T2R, T2S; in hc2cf2_16() local 356 T2Y = T2D + T2I; in hc2cf2_16() 358 T30 = FNMS(KP414213562, T2Z, T2Y); in hc2cf2_16() 359 T34 = FMA(KP414213562, T2Y, T2Z); in hc2cf2_16() 529 E T2x, T1B, T1K, T2V, T2W, T2X, T2Y, T2j, T2D, T2o, T2E, T18, T1n, T2Q, T2R; in hc2cf2_16() local 631 T2Y = T2W - T2X; in hc2cf2_16() 735 T2Z = T2V - T2Y; in hc2cf2_16() 739 T33 = T2V + T2Y; in hc2cf2_16()
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/dports/math/fftw3-long/fftw-3.3.9/dft/scalar/codelets/ |
H A D | n1_20.c | 245 E T2S, T2Q, T2R, T2W, T2Y, T2U, T2V, T2X, T2T; in n1_20() local 252 T2Y = FMA(KP618033988, T2U, T2V); in n1_20() 255 io[WS(os, 6)] = FNMS(KP951056516, T2Y, T2X); in n1_20() 256 io[WS(os, 14)] = FMA(KP951056516, T2Y, T2X); in n1_20() 591 E T2V, T2T, T2U, T2N, T2Y, T2L, T2M, T2X, T2W; in n1_20() local 598 T2Y = FMA(KP951056516, T2M, KP587785252 * T2L); in n1_20() 601 io[WS(os, 6)] = T2X - T2Y; in n1_20() 602 io[WS(os, 14)] = T2Y + T2X; in n1_20()
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H A D | t1_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in t1_16() local 286 T2Y = T2U + T2X; in t1_16() 307 ri[WS(rs, 10)] = FNMS(KP707106781, T39, T2Y); in t1_16() 308 ri[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in t1_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in t1_16() local 760 T2Y = T2V - T2Q; in t1_16() 778 ii[WS(rs, 12)] = T2Y - T2X; in t1_16() 780 ii[WS(rs, 4)] = T2X + T2Y; in t1_16()
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/dports/math/fftw3-float/fftw-3.3.9/rdft/scalar/r2cf/ |
H A D | hf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hf_16() local 286 T2Y = T2U - T2X; in hf_16() 307 ci[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hf_16() 308 cr[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hf_16() 684 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hf_16() local 694 T2Y = T2V - T2Q; in hf_16() 708 cr[WS(rs, 12)] = T2X - T2Y; in hf_16() 709 ci[WS(rs, 11)] = T2X + T2Y; in hf_16()
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H A D | hc2cf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hc2cf_16() local 286 T2Y = T2U + T2X; in hc2cf_16() 307 Rm[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hc2cf_16() 308 Rp[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hc2cf_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hc2cf_16() local 760 T2Y = T2V - T2Q; in hc2cf_16() 778 Im[WS(rs, 3)] = T2X - T2Y; in hc2cf_16() 780 Ip[WS(rs, 4)] = T2X + T2Y; in hc2cf_16()
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H A D | hf2_16.c | 355 E T2Y, T2Z, T2R, T2S; in hf2_16() local 356 T2Y = T2w + T2B; in hf2_16() 358 T30 = FNMS(KP414213562, T2Z, T2Y); in hf2_16() 359 T33 = FMA(KP414213562, T2Y, T2Z); in hf2_16() 529 E T2x, T1B, T1K, T2V, T2W, T2X, T2Y, T2j, T2E, T2o, T2D, T18, T1n, T2Q, T2R; in hf2_16() local 631 T2Y = T2W - T2X; in hf2_16() 801 T2Z = T2V - T2Y; in hf2_16() 805 T33 = T2V + T2Y; in hf2_16()
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H A D | hf_15.c | 48 E T1, T3i, T1G, T3l, Te, T1B, T3j, T3k, T1y, T2i, T2a, T2M, T37, T2Y, Tz; in hf_15() local 132 T2Y = FMA(KP866025403, T2L, T2K); in hf_15() 316 T2Z = T2X - T2Y; in hf_15() 413 T3x = T2X + T2Y; in hf_15() 757 E T2X, T31, T2U, T2P, T2Y, T2Z, T32, T30; in hf_15() local 768 T2Y = FMA(KP250000000, T2P, T2U); in hf_15() 772 T32 = T2Z + T2Y; in hf_15() 775 T30 = T2Y - T2Z; in hf_15()
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/dports/math/fftw3-float/fftw-3.3.9/dft/scalar/codelets/ |
H A D | t1_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in t1_16() local 286 T2Y = T2U + T2X; in t1_16() 307 ri[WS(rs, 10)] = FNMS(KP707106781, T39, T2Y); in t1_16() 308 ri[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in t1_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in t1_16() local 760 T2Y = T2V - T2Q; in t1_16() 778 ii[WS(rs, 12)] = T2Y - T2X; in t1_16() 780 ii[WS(rs, 4)] = T2X + T2Y; in t1_16()
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H A D | n1_20.c | 245 E T2S, T2Q, T2R, T2W, T2Y, T2U, T2V, T2X, T2T; in n1_20() local 252 T2Y = FMA(KP618033988, T2U, T2V); in n1_20() 255 io[WS(os, 6)] = FNMS(KP951056516, T2Y, T2X); in n1_20() 256 io[WS(os, 14)] = FMA(KP951056516, T2Y, T2X); in n1_20() 591 E T2V, T2T, T2U, T2N, T2Y, T2L, T2M, T2X, T2W; in n1_20() local 598 T2Y = FMA(KP951056516, T2M, KP587785252 * T2L); in n1_20() 601 io[WS(os, 6)] = T2X - T2Y; in n1_20() 602 io[WS(os, 14)] = T2Y + T2X; in n1_20()
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/dports/math/fftw3-quad/fftw-3.3.9/dft/scalar/codelets/ |
H A D | t1_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in t1_16() local 286 T2Y = T2U + T2X; in t1_16() 307 ri[WS(rs, 10)] = FNMS(KP707106781, T39, T2Y); in t1_16() 308 ri[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in t1_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in t1_16() local 760 T2Y = T2V - T2Q; in t1_16() 778 ii[WS(rs, 12)] = T2Y - T2X; in t1_16() 780 ii[WS(rs, 4)] = T2X + T2Y; in t1_16()
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H A D | n1_20.c | 245 E T2S, T2Q, T2R, T2W, T2Y, T2U, T2V, T2X, T2T; in n1_20() local 252 T2Y = FMA(KP618033988, T2U, T2V); in n1_20() 255 io[WS(os, 6)] = FNMS(KP951056516, T2Y, T2X); in n1_20() 256 io[WS(os, 14)] = FMA(KP951056516, T2Y, T2X); in n1_20() 591 E T2V, T2T, T2U, T2N, T2Y, T2L, T2M, T2X, T2W; in n1_20() local 598 T2Y = FMA(KP951056516, T2M, KP587785252 * T2L); in n1_20() 601 io[WS(os, 6)] = T2X - T2Y; in n1_20() 602 io[WS(os, 14)] = T2Y + T2X; in n1_20()
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/dports/math/fftw3-long/fftw-3.3.9/rdft/scalar/r2cf/ |
H A D | hc2cf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hc2cf_16() local 286 T2Y = T2U + T2X; in hc2cf_16() 307 Rm[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hc2cf_16() 308 Rp[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hc2cf_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hc2cf_16() local 760 T2Y = T2V - T2Q; in hc2cf_16() 778 Im[WS(rs, 3)] = T2X - T2Y; in hc2cf_16() 780 Ip[WS(rs, 4)] = T2X + T2Y; in hc2cf_16()
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H A D | hf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hf_16() local 286 T2Y = T2U - T2X; in hf_16() 307 ci[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hf_16() 308 cr[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hf_16() 684 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hf_16() local 694 T2Y = T2V - T2Q; in hf_16() 708 cr[WS(rs, 12)] = T2X - T2Y; in hf_16() 709 ci[WS(rs, 11)] = T2X + T2Y; in hf_16()
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/dports/math/fftw3/fftw-3.3.9/dft/scalar/codelets/ |
H A D | n1_20.c | 245 E T2S, T2Q, T2R, T2W, T2Y, T2U, T2V, T2X, T2T; in n1_20() local 252 T2Y = FMA(KP618033988, T2U, T2V); in n1_20() 255 io[WS(os, 6)] = FNMS(KP951056516, T2Y, T2X); in n1_20() 256 io[WS(os, 14)] = FMA(KP951056516, T2Y, T2X); in n1_20() 591 E T2V, T2T, T2U, T2N, T2Y, T2L, T2M, T2X, T2W; in n1_20() local 598 T2Y = FMA(KP951056516, T2M, KP587785252 * T2L); in n1_20() 601 io[WS(os, 6)] = T2X - T2Y; in n1_20() 602 io[WS(os, 14)] = T2Y + T2X; in n1_20()
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H A D | t1_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in t1_16() local 286 T2Y = T2U + T2X; in t1_16() 307 ri[WS(rs, 10)] = FNMS(KP707106781, T39, T2Y); in t1_16() 308 ri[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in t1_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in t1_16() local 760 T2Y = T2V - T2Q; in t1_16() 778 ii[WS(rs, 12)] = T2Y - T2X; in t1_16() 780 ii[WS(rs, 4)] = T2X + T2Y; in t1_16()
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H A D | t1_15.c | 49 E T2e, T1O, T2t, T39, T2X, TT, T2f, T1V, T2z, T3a, T2Y, T1e, T2h, T23, T2G; in t1_15() local 234 T2Y = FNMS(KP866025403, T2y, T2x); in t1_15() 339 T2Z = T2X - T2Y; in t1_15() 366 T3I = T2X + T2Y; in t1_15() 694 E T2U, T2P, T2T, T2Y, T30, T2W, T2X, T2Z, T2V; in t1_15() local 700 T2Y = FNMS(KP587785252, T2X, KP951056516 * T2W); in t1_15() 707 ii[WS(rs, 3)] = T2V - T2Y; in t1_15() 708 ii[WS(rs, 12)] = T2Y + T2V; in t1_15()
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H A D | t2_16.c | 355 E T2Y, T2Z, T2R, T2S; in t2_16() local 356 T2Y = T2D + T2I; in t2_16() 358 T30 = FNMS(KP414213562, T2Z, T2Y); in t2_16() 359 T34 = FMA(KP414213562, T2Y, T2Z); in t2_16() 529 E T2x, T1B, T1K, T2V, T2W, T2X, T2Y, T2j, T2D, T2o, T2E, T18, T1n, T2Q, T2R; in t2_16() local 631 T2Y = T2W - T2X; in t2_16() 735 T2Z = T2V - T2Y; in t2_16() 739 T33 = T2V + T2Y; in t2_16()
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/dports/math/fftw3-quad/fftw-3.3.9/rdft/scalar/r2cf/ |
H A D | hc2cf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hc2cf_16() local 286 T2Y = T2U + T2X; in hc2cf_16() 307 Rm[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hc2cf_16() 308 Rp[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hc2cf_16() 750 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hc2cf_16() local 760 T2Y = T2V - T2Q; in hc2cf_16() 778 Im[WS(rs, 3)] = T2X - T2Y; in hc2cf_16() 780 Ip[WS(rs, 4)] = T2X + T2Y; in hc2cf_16()
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H A D | hf_16.c | 281 E T2Y, T3a, T3v, T3x, T33, T3b, T38, T3c; in hf_16() local 286 T2Y = T2U - T2X; in hf_16() 307 ci[WS(rs, 5)] = FNMS(KP707106781, T39, T2Y); in hf_16() 308 cr[WS(rs, 2)] = FMA(KP707106781, T39, T2Y); in hf_16() 684 E TH, T2L, T2W, T2Y, T1s, T2X, T2O, T2P; in hf_16() local 694 T2Y = T2V - T2Q; in hf_16() 708 cr[WS(rs, 12)] = T2X - T2Y; in hf_16() 709 ci[WS(rs, 11)] = T2X + T2Y; in hf_16()
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/dports/math/fftw3-float/fftw-3.3.9/rdft/scalar/r2cb/ |
H A D | hc2cbdft_16.c | 428 E T2Y, T3m, T3k, T3o, T3c; in hc2cbdft_16() local 429 T2Y = FNMS(T2Q, T2X, T2P); in hc2cbdft_16() 434 Rp[WS(rs, 1)] = T2Y - T3k; in hc2cbdft_16() 436 Rm[WS(rs, 1)] = T2Y + T3k; in hc2cbdft_16() 486 E T2M, Tu, T1Y, T2Q, T2X, T2T, T2Y, TY, T1d, T19, T1e, T2v, T2C, T2y, T2D; in hc2cbdft_16() local 636 T2Y = FNMS(KP923879532, T2R, KP382683432 * T2S); in hc2cbdft_16() 780 T2Z = T2X + T2Y; in hc2cbdft_16() 833 T3u = T2X - T2Y; in hc2cbdft_16()
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H A D | hc2cbdft2_16.c | 428 E T2Y, T3m, T3k, T3o, T3c; in hc2cbdft2_16() local 429 T2Y = FNMS(T2Q, T2X, T2P); in hc2cbdft2_16() 434 Rp[WS(rs, 1)] = T2Y - T3k; in hc2cbdft2_16() 436 Rm[WS(rs, 1)] = T2Y + T3k; in hc2cbdft2_16() 486 E T2M, Tu, T1Y, T2Q, T2X, T2T, T2Y, TY, T1d, T19, T1e, T2v, T2C, T2y, T2D; in hc2cbdft2_16() local 636 T2Y = FNMS(KP923879532, T2R, KP382683432 * T2S); in hc2cbdft2_16() 780 T2Z = T2X + T2Y; in hc2cbdft2_16() 833 T3u = T2X - T2Y; in hc2cbdft2_16()
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/dports/math/fftw3/fftw-3.3.9/rdft/scalar/r2cb/ |
H A D | hb_15.c | 49 E Ts, Tv, T37, T3h, T28, T2h, T21, T2g, T2V, T2W, T2X, T2Y, T2Z, T30, T31; in hb_15() local 193 T2Y = FNMS(KP866025403, T1L, T1K); in hb_15() 195 T30 = T2Y + T2Z; in hb_15() 349 T3m = T2Y - T2Z; in hb_15() 728 E T31, T3h, T36, T3k, T2K, T3g, T2Y, T2U, T3l, T39, T2B, T2L; in hb_15() local 747 T2Y = T2W - T2X; in hb_15() 770 T32 = T2Y - T31; in hb_15() 779 T3c = T2Y + T31; in hb_15()
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