Friday, September 20 2024 00:46:29
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CTEST_FULL_OUTPUT T -1436464 2 T -1436464 5 T -1436464 6 T -1436464 9 T -1436464 10 T -1436464 12 T -1436464 14 T -1436464 15 T -1436464 16 T -1436464 17 T -1436464 18 T -1436464 20 T -1436464 21 T -1436464 22 T -1436464 24 T -1436464 27 T -1436464 29 T -1436464 30 T -1436464 32 T -1436464 34 T -1436464 35 T -1436464 38 T -1436464 40 T -1436464 41 T -1436464 45 T -1436464 51 T -1436464 52 T -1436464 57 T -1436464 64 T -1436464 66 T -1436464 67 T -1436464 71 T -1436464 78 T -1436464 79 T -1436464 85 T -1436464 86 T -1436464 91 T -1436464 101 T -1436464 106 T -1436464 107 T -1436464 108 T -1436464 110 T -1436464 112 T -1436464 117 T -1436464 118 T -1436464 119 T -1436464 121 T -1436464 125 T -1436464 127 T -1436464 128 T -1436464 132 T -1436464 136 T -1436464 139 T -1436464 141 T -1436464 142 T -1436464 148 T -1436464 151 T -1436464 159 T -1436464 167 T -1436464 168 T -1436464 171 T -1436464 178 T -1436464 179 T -1436464 182 T -1436464 191 T -1436464 193 T -1436464 197 T -1436464 209 T 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330 T -1436464 341 T -1436464 344 T -1436464 345 T -1436464 354 T -1436464 356 T -1436464 365 T -1436464 367 T -1436464 368 T -1436464 374 T -1436464 378 T -1436464 388 T -1436464 393 T -1436464 400 T -1436464 401 T -1436464 406 T -1436464 407 T -1436464 410 T -1436464 412 T -1436464 413 T -1436464 417 T -1436464 428 T -1436464 432 T -1436464 435 T -1436464 438 T -1436464 441 T -1436464 442 T -1436464 443 T -1436464 447 T -1436464 449 T -1436464 451 T -1436464 463 T -1436464 469 T -1436464 474 T -1436464 478 T -1436464 487 T -1436464 494 T -1436464 512 T -1436464 514 T -1436464 519 T -1436464 521 T -1436464 523 T -1436464 524 T -1436464 526 T -1436464 529 T -1436464 533 T -1436464 540 T -1436464 542 T -1436464 543 T -1436464 548 T -1436464 549 T -1436464 554 T -1436464 557 T -1436464 562 T -1436464 564 T -1436464 566 T -1436464 572 T -1436464 575 T -1436464 1 T -1436464 11 T -1436464 19 T -1436464 31 T -1436464 36 T -1436464 42 T -1436464 47 T -1436464 48 T -1436464 49 T -1436464 50 T 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STOP ********** Program terminated normally. T -1436464 347 T -1436464 358 T -1436464 359 T -1436464 361 T -1436464 366 T -1436464 372 T -1436464 382 T -1436464 383 T -1436464 384 T -1436464 394 T -1436464 396 T -1436464 399 T -1436464 402 T -1436464 408 T -1436464 409 T -1436464 416 T -1436464 420 T -1436464 421 T -1436464 422 T -1436464 430 T -1436464 433 T -1436464 458 T -1436464 465 T -1436464 468 T -1436464 470 T -1436464 472 T -1436464 473 T -1436464 480 T -1436464 482 T -1436464 486 T -1436464 488 T -1436464 490 T -1436464 491 T -1436464 495 T -1436464 496 T -1436464 503 T -1436464 504 T -1436464 505 T -1436464 508 T -1436464 516 T -1436464 518 T -1436464 520 T -1436464 525 T -1436464 527 T -1436464 528 T -1436464 532 T -1436464 536 T -1436464 541 T -1436464 556 T -1436464 565 T -1436464 569 T -1436464 571 T -1436464 3 T -1436464 4 T -1436464 7 T -1436464 8 T -1436464 13 T -1436464 63 T -1436464 75 T -1436464 89 T -1436464 93 T -1436464 94 T -1436464 96 T -1436464 130 T -1436464 131 T -1436464 155 T -1436464 160 T -1436464 164 T -1436464 177 T -1436464 232 T -1436464 238 T -1436464 242 T -1436464 248 T -1436464 249 T -1436464 301 T -1436464 308 T -1436464 312 T -1436464 323 T -1436464 331 T -1436464 349 T -1436464 350 T -1436464 363 T -1436464 364 T -1436464 375 T -1436464 379 T -1436464 385 T -1436464 391 T -1436464 395 T -1436464 404 T -1436464 411 T -1436464 424 T -1436464 425 T -1436464 426 T -1436464 427 T -1436464 439 T -1436464 446 T -1436464 450 T -1436464 452 T -1436464 453 T -1436464 462 T -1436464 477 T -1436464 479 T -1436464 484 T -1436464 485 T -1436464 489 T -1436464 493 T -1436464 500 T -1436464 501 T -1436464 513 T -1436464 515 T -1436464 517 T -1436464 530 T -1436464 535 T -1436464 545 T -1436464 547 T -1436464 553 T -1436464 559 T -1436464 560 T -1436464 567 T -1436464 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
