Friday, September 20 2024 09:05:16
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0.82s
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CTEST_FULL_OUTPUT T 12965952 2 T 12965952 5 T 12965952 6 T 12965952 9 T 12965952 10 T 12965952 12 T 12965952 14 T 12965952 15 T 12965952 16 T 12965952 17 T 12965952 18 T 12965952 20 T 12965952 21 T 12965952 22 T 12965952 24 T 12965952 27 T 12965952 29 T 12965952 30 T 12965952 32 T 12965952 34 T 12965952 35 T 12965952 38 T 12965952 40 T 12965952 41 T 12965952 45 T 12965952 51 T 12965952 52 T 12965952 57 T 12965952 64 T 12965952 66 T 12965952 67 T 12965952 71 T 12965952 78 T 12965952 79 T 12965952 85 T 12965952 86 T 12965952 91 T 12965952 101 T 12965952 106 T 12965952 107 T 12965952 108 T 12965952 110 T 12965952 112 T 12965952 117 T 12965952 118 T 12965952 119 T 12965952 121 T 12965952 125 T 12965952 127 T 12965952 128 T 12965952 132 T 12965952 136 T 12965952 139 T 12965952 141 T 12965952 142 T 12965952 148 T 12965952 151 T 12965952 159 T 12965952 167 T 12965952 168 T 12965952 171 T 12965952 178 T 12965952 179 T 12965952 182 T 12965952 191 T 12965952 193 T 12965952 197 T 12965952 209 T 12965952 210 T 12965952 212 T 12965952 218 T 12965952 221 T 12965952 222 T 12965952 227 T 12965952 231 T 12965952 233 T 12965952 235 T 12965952 251 T 12965952 252 T 12965952 254 T 12965952 256 T 12965952 259 T 12965952 260 T 12965952 267 T 12965952 269 T 12965952 276 T 12965952 278 T 12965952 280 T 12965952 284 T 12965952 295 T 12965952 297 T 12965952 299 T 12965952 300 T 12965952 303 T 12965952 314 T 12965952 315 T 12965952 318 T 12965952 319 T 12965952 324 T 12965952 326 T 12965952 329 T 12965952 340 T 12965952 343 T 12965952 346 T 12965952 348 T 12965952 352 T 12965952 353 T 12965952 355 T 12965952 357 T 12965952 360 T 12965952 362 T 12965952 371 T 12965952 373 T 12965952 376 T 12965952 386 T 12965952 390 T 12965952 392 T 12965952 405 T 12965952 414 T 12965952 415 T 12965952 419 T 12965952 431 T 12965952 434 T 12965952 436 T 12965952 437 T 12965952 444 T 12965952 448 T 12965952 454 T 12965952 481 T 12965952 483 T 12965952 492 T 12965952 499 T 12965952 509 T 12965952 511 T 12965952 537 T 12965952 538 T 12965952 544 T 12965952 546 T 12965952 552 T 12965952 555 T 12965952 558 T 12965952 563 T 12965952 573 T 12965952 574 T 12965952 23 T 12965952 25 T 12965952 26 T 12965952 33 T 12965952 37 T 12965952 39 T 12965952 44 T 12965952 46 T 12965952 55 T 12965952 56 T 12965952 61 T 12965952 68 T 12965952 73 T 12965952 81 T 12965952 82 T 12965952 87 T 12965952 88 T 12965952 95 T 12965952 98 T 12965952 99 T 12965952 102 T 12965952 104 T 12965952 105 T 12965952 113 T 12965952 114 T 12965952 115 T 12965952 122 T 12965952 123 T 12965952 124 T 12965952 134 T 12965952 135 T 12965952 138 T 12965952 144 T 12965952 147 T 12965952 149 T 12965952 152 T 12965952 154 T 12965952 158 T 12965952 162 T 12965952 172 T 12965952 173 T 12965952 175 T 12965952 185 T 12965952 186 T 12965952 192 T 12965952 195 T 12965952 203 T 12965952 204 T 12965952 205 T 12965952 206 T 12965952 214 T 12965952 224 T 12965952 228 T 12965952 234 T 12965952 239 T 12965952 240 T 12965952 243 T 12965952 246 T 12965952 253 T 12965952 258 T 12965952 261 T 12965952 263 T 12965952 270 T 12965952 271 T 12965952 274 T 12965952 275 T 12965952 277 T 12965952 282 T 12965952 285 T 12965952 286 T 12965952 287 T 12965952 289 T 12965952 291 T 12965952 296 T 12965952 304 T 12965952 307 T 12965952 311 T 12965952 316 T 12965952 321 T 12965952 325 T 12965952 328 T 12965952 332 T 12965952 334 T 12965952 335 T 12965952 337 T 12965952 351 T 12965952 369 T 12965952 370 T 12965952 377 T 12965952 380 T 12965952 381 T 12965952 387 T 12965952 389 T 12965952 397 T 12965952 398 T 12965952 403 T 12965952 418 T 12965952 423 T 12965952 429 T 12965952 440 T 12965952 445 T 12965952 455 T 12965952 456 T 12965952 457 T 12965952 459 T 12965952 460 T 12965952 461 T 12965952 464 T 12965952 466 T 12965952 467 T 12965952 471 T 12965952 475 T 12965952 476 T 12965952 497 T 12965952 498 T 12965952 502 T 12965952 506 T 12965952 507 T 12965952 510 T 12965952 522 T 12965952 531 T 12965952 534 T 12965952 539 T 12965952 550 T 12965952 551 T 12965952 561 T 12965952 568 T 12965952 28 T 12965952 43 T 12965952 53 T 12965952 59 T 12965952 62 T 12965952 65 T 12965952 70 T 12965952 76 T 12965952 77 T 12965952 80 T 12965952 84 T 12965952 90 T 12965952 92 T 12965952 97 T 12965952 103 T 12965952 109 T 12965952 126 T 12965952 129 T 12965952 133 T 12965952 137 T 12965952 143 T 12965952 145 T 12965952 146 T 12965952 150 T 12965952 153 T 12965952 157 T 12965952 169 T 12965952 170 T 12965952 174 T 12965952 176 T 12965952 180 T 12965952 181 T 12965952 184 T 12965952 196 T 12965952 200 T 12965952 201 T 12965952 202 T 12965952 207 T 12965952 208 T 12965952 211 T 12965952 213 T 12965952 216 T 12965952 217 T 12965952 219 T 12965952 220 T 12965952 223 T 12965952 230 T 12965952 236 T 12965952 241 T 12965952 244 T 12965952 245 T 12965952 247 T 12965952 265 T 12965952 268 T 12965952 272 T 12965952 279 T 12965952 283 T 12965952 292 T 12965952 293 T 12965952 298 T 12965952 302 T 12965952 305 T 12965952 313 T 12965952 317 T 12965952 322 T 12965952 330 T 12965952 341 T 12965952 344 T 12965952 345 T 12965952 354 T 12965952 356 T 12965952 365 T 12965952 367 T 12965952 368 T 12965952 374 T 12965952 378 T 12965952 388 T 12965952 393 T 12965952 400 T 12965952 401 T 12965952 406 T 12965952 407 T 12965952 410 T 12965952 412 T 12965952 413 T 12965952 417 T 12965952 428 T 12965952 432 T 12965952 435 T 12965952 438 T 12965952 441 T 12965952 442 T 12965952 443 T 12965952 447 T 12965952 449 T 12965952 451 T 12965952 463 T 12965952 469 T 12965952 474 T 12965952 478 T 12965952 487 T 12965952 494 T 12965952 512 T 12965952 514 T 12965952 519 T 12965952 521 T 12965952 523 T 12965952 524 T 12965952 526 T 12965952 529 T 12965952 533 T 12965952 540 T 12965952 542 T 12965952 543 T 12965952 548 T 12965952 549 T 12965952 554 T 12965952 557 T 12965952 562 T 12965952 564 T 12965952 566 T 12965952 572 T 12965952 575 T 12965952 1 T 12965952 11 T 12965952 19 T 12965952 31 T 12965952 36 T 12965952 42 T 12965952 47 T 12965952 48 T 12965952 49 T 12965952 50 T 12965952 54 T 12965952 58 T 12965952 60 T 12965952 69 T 12965952 72 T 12965952 74 T 12965952 83 T 12965952 100 T 12965952 111 T 12965952 116 T 12965952 120 T 12965952 140 T 12965952 156 T 12965952 161 T 12965952 163 T 12965952 165 T 12965952 166 T 12965952 183 T 12965952 187 T 12965952 188 T 12965952 189 T 12965952 190 T 12965952 194 T 12965952 198 T 12965952 199 T 12965952 215 T 12965952 225 T 12965952 226 T 12965952 229 T 12965952 237 T 12965952 250 T 12965952 255 T 12965952 257 T 12965952 262 T 12965952 264 T 12965952 266 T 12965952 273 T 12965952 281 T 12965952 288 T 12965952 290 T 12965952 294 T 12965952 306 T 12965952 309 T 12965952 310 T 12965952 320 T 12965952 327 T 12965952 333 T 12965952 336 T 12965952 338 T 12965952 339 T 12965952 342 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 12965952 347 T 12965952 358 T 12965952 359 T 12965952 361 T 12965952 366 T 12965952 372 T 12965952 382 T 12965952 383 T 12965952 384 T 12965952 394 T 12965952 396 T 12965952 399 T 12965952 402 T 12965952 408 T 12965952 409 T 12965952 416 T 12965952 420 T 12965952 421 T 12965952 422 T 12965952 430 T 12965952 433 T 12965952 458 T 12965952 465 T 12965952 468 T 12965952 470 T 12965952 472 T 12965952 473 T 12965952 480 T 12965952 482 T 12965952 486 T 12965952 488 T 12965952 490 T 12965952 491 T 12965952 495 T 12965952 496 T 12965952 503 T 12965952 504 T 12965952 505 T 12965952 508 T 12965952 516 T 12965952 518 T 12965952 520 T 12965952 525 T 12965952 527 T 12965952 528 T 12965952 532 T 12965952 536 T 12965952 541 T 12965952 556 T 12965952 565 T 12965952 569 T 12965952 571 T 12965952 3 T 12965952 4 T 12965952 7 T 12965952 8 T 12965952 13 T 12965952 63 T 12965952 75 T 12965952 89 T 12965952 93 T 12965952 94 T 12965952 96 T 12965952 130 T 12965952 131 T 12965952 155 T 12965952 160 T 12965952 164 T 12965952 177 T 12965952 232 T 12965952 238 T 12965952 242 T 12965952 248 T 12965952 249 T 12965952 301 T 12965952 308 T 12965952 312 T 12965952 323 T 12965952 331 T 12965952 349 T 12965952 350 T 12965952 363 T 12965952 364 T 12965952 375 T 12965952 379 T 12965952 385 T 12965952 391 T 12965952 395 T 12965952 404 T 12965952 411 T 12965952 424 T 12965952 425 T 12965952 426 T 12965952 427 T 12965952 439 T 12965952 446 T 12965952 450 T 12965952 452 T 12965952 453 T 12965952 462 T 12965952 477 T 12965952 479 T 12965952 484 T 12965952 485 T 12965952 489 T 12965952 493 T 12965952 500 T 12965952 501 T 12965952 513 T 12965952 515 T 12965952 517 T 12965952 530 T 12965952 535 T 12965952 545 T 12965952 547 T 12965952 553 T 12965952 559 T 12965952 560 T 12965952 567 T 12965952 570 THERE ARE 5 FAMILIES OF CONFORMATIONS 1L2Y_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY -3.65540E+00 AVE RMSD 3.31 1L2Y_wham_T280K_0001.pdb:REMARK 1L2Y clustering ENERGY -1.20358E+00 RMS 3.55 1L2Y_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -3.50455E+00 AVE RMSD 2.71 1L2Y_wham_T280K_0002.pdb:REMARK 1L2Y clustering ENERGY -1.19195E+00 RMS 2.78 1L2Y_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -3.40308E+00 AVE RMSD 3.24 1L2Y_wham_T280K_0003.pdb:REMARK 1L2Y clustering ENERGY -1.18961E+00 RMS 3.08 1L2Y_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -3.35113E+00 AVE RMSD 2.85 1L2Y_wham_T280K_0004.pdb:REMARK 1L2Y clustering ENERGY -1.20366E+00 RMS 3.03 1L2Y_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -2.98650E+00 AVE RMSD 5.18 1L2Y_wham_T280K_0005.pdb:REMARK 1L2Y clustering ENERGY -1.20178E+00 RMS 4.47
