Mercurial > repos > prog > lcmsmatching
comparison test-data/test_3_peaks_output.html @ 6:f86fec07f392 draft default tip
planemo upload commit c397cd8a93953798d733fd62653f7098caac30ce
| author | prog |
|---|---|
| date | Fri, 22 Feb 2019 16:04:22 -0500 |
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| 5:fb9c0409d85c | 6:f86fec07f392 |
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| 1 <html> | |
| 2 <header> | |
| 3 <meta charset="UTF-8"/> | |
| 4 <title>LC/MS matching results</title> | |
| 5 <style> | |
| 6 table, th, td { border-collapse: collapse; } | |
| 7 table, th { border: 1px solid black; } | |
| 8 td { border-left: 1px solid black; border-right: 1px solid black; } | |
| 9 th, td { padding: 5px; } | |
| 10 th { background-color: LightBlue; } | |
| 11 tr:nth-child(even) { background-color: LemonChiffon; } | |
| 12 tr:nth-child(odd) { background-color: LightGreen; } | |
| 13 </style> | |
| 14 </header> | |
| 15 <body> | |
| 16 <h3>Matched peaks</h3> | |
| 17 <table> | |
| 18 <tr> | |
| 19 <th>mz</th> | |
| 20 <th>rt</th> | |
| 21 <th>lcmsmatching.accession</th> | |
| 22 <th>lcmsmatching.chrom.col.id</th> | |
| 23 <th>lcmsmatching.chrom.col.name</th> | |
| 24 <th>lcmsmatching.chrom.rt</th> | |
| 25 <th>lcmsmatching.chrom.rt.unit</th> | |
| 26 <th>lcmsmatching.compound.id</th> | |
| 27 <th>lcmsmatching.formula</th> | |
| 28 <th>lcmsmatching.mass.csv.file.id</th> | |
| 29 <th>lcmsmatching.molecular.mass</th> | |
| 30 <th>lcmsmatching.ms.level</th> | |
| 31 <th>lcmsmatching.ms.mode</th> | |
| 32 <th>lcmsmatching.msprecmz</th> | |
| 33 <th>lcmsmatching.name</th> | |
| 34 <th>lcmsmatching.peak.attr</th> | |
| 35 <th>lcmsmatching.peak.comp</th> | |
| 36 <th>lcmsmatching.peak.mz</th> | |
| 37 <th>lcmsmatching.peak.mztheo</th> | |
| 38 </tr> | |
| 39 <tr> | |
| 40 <td>80.04959</td> | |
| 41 <td>339.9726</td> | |
| 42 <td/> | |
| 43 <td/> | |
| 44 <td/> | |
| 45 <td/> | |
| 46 <td/> | |
| 47 <td/> | |
| 48 <td/> | |
| 49 <td/> | |
| 50 <td/> | |
| 51 <td/> | |
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| 53 <td/> | |
| 54 <td/> | |
| 55 <td/> | |
| 56 <td/> | |
| 57 <td/> | |
| 58 <td/> | |
| 59 </tr> | |
| 60 <tr> | |
| 61 <td>82.04819</td> | |
| 62 <td>1593.54</td> | |
| 63 <td/> | |
| 64 <td/> | |
| 65 <td/> | |
| 66 <td/> | |
| 67 <td/> | |
| 68 <td/> | |
| 69 <td/> | |
| 70 <td/> | |
| 71 <td/> | |
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| 74 <td/> | |
| 75 <td/> | |
| 76 <td/> | |
| 77 <td/> | |
| 78 <td/> | |
| 79 <td/> | |
| 80 </tr> | |
| 81 <tr> | |
| 82 <td>83.01344</td> | |
| 83 <td>654.9536</td> | |
| 84 <td/> | |
| 85 <td/> | |
| 86 <td/> | |
| 87 <td/> | |
| 88 <td/> | |
| 89 <td/> | |
| 90 <td/> | |
| 91 <td/> | |
| 92 <td/> | |
| 93 <td/> | |
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| 95 <td/> | |
| 96 <td/> | |
| 97 <td/> | |
| 98 <td/> | |
| 99 <td/> | |
| 100 <td/> | |
| 101 </tr> | |
| 102 <tr> | |
| 103 <td>84.05585</td> | |
| 104 <td>4.748269</td> | |
| 105 <td/> | |
| 106 <td/> | |
| 107 <td/> | |
| 108 <td/> | |
| 109 <td/> | |
| 110 <td/> | |
| 111 <td/> | |
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| 117 <td/> | |
| 118 <td/> | |
| 119 <td/> | |
| 120 <td/> | |
| 121 <td/> | |
| 122 </tr> | |
| 123 <tr> | |
| 124 <td>87.05536</td> | |
| 125 <td>3.480291</td> | |
| 126 <td/> | |
| 127 <td/> | |
| 128 <td/> | |
| 129 <td/> | |
| 130 <td/> | |
| 131 <td/> | |
| 132 <td/> | |
| 133 <td/> | |
| 134 <td/> | |
| 135 <td/> | |
| 136 <td/> | |
| 137 <td/> | |
| 138 <td/> | |
| 139 <td/> | |
| 140 <td/> | |
| 141 <td/> | |
| 142 <td/> | |
| 143 </tr> | |
| 144 <tr> | |
| 145 <td>89.50682</td> | |
| 146 <td>39.62335</td> | |
| 147 <td/> | |
| 148 <td/> | |
| 149 <td/> | |
| 150 <td/> | |
| 151 <td/> | |
| 152 <td/> | |
| 153 <td/> | |
| 154 <td/> | |
| 155 <td/> | |
| 156 <td/> | |
| 157 <td/> | |
| 158 <td/> | |
| 159 <td/> | |
| 160 <td/> | |
| 161 <td/> | |
| 162 <td/> | |
| 163 <td/> | |
| 164 </tr> | |
| 165 <tr> | |
| 166 <td>90.97681</td> | |
| 167 <td>1598.991</td> | |
| 168 <td/> | |
| 169 <td/> | |
| 170 <td/> | |
| 171 <td/> | |
| 172 <td/> | |
| 173 <td/> | |
| 174 <td/> | |
| 175 <td/> | |
| 176 <td/> | |
| 177 <td/> | |
| 178 <td/> | |
| 179 <td/> | |
| 180 <td/> | |
| 181 <td/> | |
| 182 <td/> | |
| 183 <td/> | |
| 184 <td/> | |
| 185 </tr> | |
| 186 <tr> | |
| 187 <td>92.98093</td> | |
| 188 <td>46.13716</td> | |
| 189 <td/> | |
| 190 <td/> | |
| 191 <td/> | |
| 192 <td/> | |
| 193 <td/> | |
| 194 <td/> | |
| 195 <td/> | |
| 196 <td/> | |
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| 198 <td/> | |
| 199 <td/> | |
| 200 <td/> | |
| 201 <td/> | |
| 202 <td/> | |
| 203 <td/> | |
| 204 <td/> | |
| 205 <td/> | |
| 206 </tr> | |
| 207 <tr> | |
| 208 <td>94.57331</td> | |
| 209 <td>44.37588</td> | |
| 210 <td>A10.pos.col12.0.8</td> | |
| 211 <td>col12</td> | |
| 212 <td>col12</td> | |
| 213 <td>0.8</td> | |
| 214 <td>min</td> | |
| 215 <td>A10</td> | |
| 216 <td>J114L6M62O2</td> | |
| 217 <td>A10.pos.col12.0.8</td> | |
| 218 <td>146.1055</td> | |
| 219 <td>1</td> | |
| 220 <td>pos</td> | |
| 221 <td>147.1128</td> | |
| 222 <td>Blablaine</td> | |
| 223 <td>19</td> | |
| 224 <td>P93Z8W419 O2</td> | |
| 225 <td>94.57331</td> | |
| 226 <td>94.57331</td> | |
| 227 </tr> | |
| 228 <tr> | |
| 229 <td>97.07603</td> | |
| 230 <td>655.2993</td> | |
| 231 <td/> | |
| 232 <td/> | |
| 233 <td/> | |
| 234 <td/> | |
| 235 <td/> | |
| 236 <td/> | |
| 237 <td/> | |
| 238 <td/> | |
| 239 <td/> | |
| 240 <td/> | |
| 241 <td/> | |
| 242 <td/> | |
| 243 <td/> | |
| 244 <td/> | |
| 245 <td/> | |
| 246 <td/> | |
| 247 <td/> | |
| 248 </tr> | |
| 249 <tr> | |
| 250 <td>99.54296</td> | |
| 251 <td>42.19534</td> | |
| 252 <td/> | |
| 253 <td/> | |
| 254 <td/> | |
| 255 <td/> | |
| 256 <td/> | |
| 257 <td/> | |
| 258 <td/> | |
| 259 <td/> | |
| 260 <td/> | |
| 261 <td/> | |
| 262 <td/> | |
| 263 <td/> | |
| 264 <td/> | |
| 265 <td/> | |
| 266 <td/> | |
| 267 <td/> | |
| 268 <td/> | |
| 269 </tr> | |
| 270 <tr> | |
| 271 <td>101.0709</td> | |
| 272 <td>733.3085</td> | |
| 273 <td/> | |
| 274 <td/> | |
| 275 <td/> | |
| 276 <td/> | |
| 277 <td/> | |
| 278 <td/> | |
| 279 <td/> | |
| 280 <td/> | |
| 281 <td/> | |
| 282 <td/> | |
| 283 <td/> | |
| 284 <td/> | |
| 285 <td/> | |
| 286 <td/> | |
| 287 <td/> | |
| 288 <td/> | |
| 289 <td/> | |
| 290 </tr> | |
| 291 <tr> | |
| 292 <td>102.0663</td> | |
| 293 <td>52.02655</td> | |
| 294 <td/> | |
| 295 <td/> | |
| 296 <td/> | |
| 297 <td/> | |
| 298 <td/> | |
| 299 <td/> | |
| 300 <td/> | |
| 301 <td/> | |
| 302 <td/> | |
| 303 <td/> | |
| 304 <td/> | |
| 305 <td/> | |
| 306 <td/> | |
| 307 <td/> | |
| 308 <td/> | |
| 309 <td/> | |
| 310 <td/> | |
| 311 </tr> | |
| 312 <tr> | |
| 313 <td>102.2845</td> | |
| 314 <td>1601.345</td> | |
| 315 <td/> | |
| 316 <td/> | |
| 317 <td/> | |
| 318 <td/> | |
| 319 <td/> | |
| 320 <td/> | |
| 321 <td/> | |
| 322 <td/> | |
| 323 <td/> | |
| 324 <td/> | |
| 325 <td/> | |
| 326 <td/> | |
| 327 <td/> | |
| 328 <td/> | |
| 329 <td/> | |
| 330 <td/> | |
| 331 <td/> | |
| 332 </tr> | |
| 333 <tr> | |
| 334 <td>104.0034</td> | |
| 335 <td>48.82052</td> | |
| 336 <td/> | |
| 337 <td/> | |
| 338 <td/> | |
| 339 <td/> | |
| 340 <td/> | |
| 341 <td/> | |
| 342 <td/> | |
| 343 <td/> | |
| 344 <td/> | |
| 345 <td/> | |
| 346 <td/> | |
| 347 <td/> | |
| 348 <td/> | |
| 349 <td/> | |
| 350 <td/> | |
| 351 <td/> | |
| 352 <td/> | |
| 353 </tr> | |
| 354 <tr> | |
| 355 <td>104.5318</td> | |
| 356 <td>1602.887</td> | |
| 357 <td/> | |
| 358 <td/> | |
| 359 <td/> | |
| 360 <td/> | |
| 361 <td/> | |
| 362 <td/> | |
| 363 <td/> | |
| 364 <td/> | |
| 365 <td/> | |
| 366 <td/> | |
| 367 <td/> | |
| 368 <td/> | |
| 369 <td/> | |
| 370 <td/> | |
| 371 <td/> | |
| 372 <td/> | |
| 373 <td/> | |
| 374 </tr> | |
| 375 <tr> | |
| 376 <td>105.4461</td> | |
| 377 <td>1611.92</td> | |
| 378 <td/> | |
| 379 <td/> | |
| 380 <td/> | |
| 381 <td/> | |
| 382 <td/> | |
| 383 <td/> | |
| 384 <td/> | |
| 385 <td/> | |
| 386 <td/> | |
| 387 <td/> | |
| 388 <td/> | |
| 389 <td/> | |
| 390 <td/> | |
| 391 <td/> | |
| 392 <td/> | |
| 393 <td/> | |
| 394 <td/> | |
| 395 </tr> | |
| 396 <tr> | |
| 397 <td>105.7271</td> | |
| 398 <td>1611.835</td> | |
| 399 <td/> | |
| 400 <td/> | |
| 401 <td/> | |
| 402 <td/> | |
| 403 <td/> | |
| 404 <td/> | |
| 405 <td/> | |
| 406 <td/> | |
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| 408 <td/> | |
| 409 <td/> | |
| 410 <td/> | |
| 411 <td/> | |
| 412 <td/> | |
| 413 <td/> | |
| 414 <td/> | |
| 415 <td/> | |
| 416 </tr> | |
| 417 <tr> | |
| 418 <td>106.0231</td> | |
| 419 <td>64.49319</td> | |
| 420 <td/> | |
| 421 <td/> | |
| 422 <td/> | |
| 423 <td/> | |
| 424 <td/> | |
| 425 <td/> | |
| 426 <td/> | |
| 427 <td/> | |
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| 430 <td/> | |
| 431 <td/> | |
| 432 <td/> | |
| 433 <td/> | |
| 434 <td/> | |
| 435 <td/> | |
| 436 <td/> | |
| 437 </tr> | |
| 438 <tr> | |
| 439 <td>106.24</td> | |
| 440 <td>1612.326</td> | |
| 441 <td/> | |
| 442 <td/> | |
| 443 <td/> | |
| 444 <td/> | |
| 445 <td/> | |
| 446 <td/> | |
| 447 <td/> | |
| 448 <td/> | |
| 449 <td/> | |
| 450 <td/> | |
| 451 <td/> | |
| 452 <td/> | |
| 453 <td/> | |
| 454 <td/> | |
| 455 <td/> | |
| 456 <td/> | |
| 457 <td/> | |
| 458 </tr> | |
| 459 <tr> | |
| 460 <td>106.5116</td> | |
| 461 <td>1612.173</td> | |
| 462 <td/> | |
| 463 <td/> | |
| 464 <td/> | |
| 465 <td/> | |
| 466 <td/> | |
| 467 <td/> | |
| 468 <td/> | |
| 469 <td/> | |
| 470 <td/> | |
| 471 <td/> | |
| 472 <td/> | |
| 473 <td/> | |
| 474 <td/> | |
| 475 <td/> | |
| 476 <td/> | |
| 477 <td/> | |
| 478 <td/> | |
| 479 </tr> | |
| 480 <tr> | |
| 481 <td>106.763</td> | |
| 482 <td>1611.85</td> | |
| 483 <td/> | |
| 484 <td/> | |
| 485 <td/> | |
| 486 <td/> | |
| 487 <td/> | |
| 488 <td/> | |
| 489 <td/> | |
| 490 <td/> | |
| 491 <td/> | |
| 492 <td/> | |
| 493 <td/> | |
| 494 <td/> | |
| 495 <td/> | |
| 496 <td/> | |
| 497 <td/> | |
| 498 <td/> | |
| 499 <td/> | |
| 500 </tr> | |
| 501 <tr> | |
| 502 <td>106.9815</td> | |
| 503 <td>1611.648</td> | |
| 504 <td/> | |
| 505 <td/> | |
| 506 <td/> | |
| 507 <td/> | |
| 508 <td/> | |
| 509 <td/> | |
| 510 <td/> | |
| 511 <td/> | |
| 512 <td/> | |
| 513 <td/> | |
| 514 <td/> | |
| 515 <td/> | |
| 516 <td/> | |
| 517 <td/> | |
| 518 <td/> | |
| 519 <td/> | |
| 520 <td/> | |
| 521 </tr> | |
| 522 <tr> | |
| 523 <td>107.2424</td> | |
| 524 <td>1611.575</td> | |
| 525 <td/> | |
| 526 <td/> | |
| 527 <td/> | |
| 528 <td/> | |
| 529 <td/> | |
| 530 <td/> | |
| 531 <td/> | |
| 532 <td/> | |
| 533 <td/> | |
| 534 <td/> | |
| 535 <td/> | |
| 536 <td/> | |
| 537 <td/> | |
| 538 <td/> | |
| 539 <td/> | |
| 540 <td/> | |
| 541 <td/> | |
| 542 </tr> | |
| 543 <tr> | |
| 544 <td>107.4569</td> | |
| 545 <td>1611.779</td> | |
| 546 <td/> | |
| 547 <td/> | |
| 548 <td/> | |
| 549 <td/> | |
| 550 <td/> | |
| 551 <td/> | |
| 552 <td/> | |
| 553 <td/> | |
| 554 <td/> | |
| 555 <td/> | |
| 556 <td/> | |
| 557 <td/> | |
| 558 <td/> | |
| 559 <td/> | |
| 560 <td/> | |
| 561 <td/> | |
| 562 <td/> | |
| 563 </tr> | |
| 564 <tr> | |
| 565 <td>107.6885</td> | |
| 566 <td>1611.622</td> | |
| 567 <td/> | |
| 568 <td/> | |
| 569 <td/> | |
| 570 <td/> | |
| 571 <td/> | |
| 572 <td/> | |
| 573 <td/> | |
| 574 <td/> | |
| 575 <td/> | |
| 576 <td/> | |
| 577 <td/> | |
| 578 <td/> | |
| 579 <td/> | |
| 580 <td/> | |
| 581 <td/> | |
| 582 <td/> | |
| 583 <td/> | |
| 584 </tr> | |
| 585 <tr> | |
| 586 <td>107.9273</td> | |
| 587 <td>1611.146</td> | |
| 588 <td/> | |
| 589 <td/> | |
| 590 <td/> | |
| 591 <td/> | |
| 592 <td/> | |
| 593 <td/> | |
| 594 <td/> | |
| 595 <td/> | |
| 596 <td/> | |
| 597 <td/> | |
| 598 <td/> | |
| 599 <td/> | |
| 600 <td/> | |
| 601 <td/> | |
| 602 <td/> | |
| 603 <td/> | |
| 604 <td/> | |
| 605 </tr> | |
| 606 <tr> | |
| 607 <td>108.1576</td> | |
| 608 <td>1611.665</td> | |
| 609 <td/> | |
| 610 <td/> | |
| 611 <td/> | |
| 612 <td/> | |
| 613 <td/> | |
| 614 <td/> | |
| 615 <td/> | |
| 616 <td/> | |
| 617 <td/> | |
| 618 <td/> | |
| 619 <td/> | |
| 620 <td/> | |
| 621 <td/> | |
| 622 <td/> | |
| 623 <td/> | |
| 624 <td/> | |
| 625 <td/> | |
| 626 </tr> | |
| 627 <tr> | |
| 628 <td>109.0777</td> | |
| 629 <td>3.299197</td> | |
| 630 <td/> | |
| 631 <td/> | |
| 632 <td/> | |
| 633 <td/> | |
| 634 <td/> | |
| 635 <td/> | |
| 636 <td/> | |
| 637 <td/> | |
| 638 <td/> | |
| 639 <td/> | |
| 640 <td/> | |
| 641 <td/> | |
| 642 <td/> | |
| 643 <td/> | |
| 644 <td/> | |
| 645 <td/> | |
| 646 <td/> | |
| 647 </tr> | |
| 648 <tr> | |
| 649 <td>110.0599</td> | |
| 650 <td>3.456417</td> | |
| 651 <td/> | |
| 652 <td/> | |
| 653 <td/> | |
| 654 <td/> | |
| 655 <td/> | |
| 656 <td/> | |
| 657 <td/> | |
| 658 <td/> | |
| 659 <td/> | |
| 660 <td/> | |
| 661 <td/> | |
| 662 <td/> | |
| 663 <td/> | |
| 664 <td/> | |
| 665 <td/> | |
| 666 <td/> | |
| 667 <td/> | |
| 668 </tr> | |
| 669 <tr> | |
| 670 <td>147.1128</td> | |
| 671 <td>48</td> | |
| 672 <td>A10.pos.col12.0.8</td> | |
| 673 <td>col12</td> | |
| 674 <td>col12</td> | |
| 675 <td>0.8</td> | |
| 676 <td>min</td> | |
| 677 <td>A10</td> | |
| 678 <td>J114L6M62O2</td> | |
| 679 <td>A10.pos.col12.0.8</td> | |
| 680 <td>146.1055</td> | |
| 681 <td>1</td> | |
| 682 <td>pos</td> | |
| 683 <td>147.1128</td> | |
| 684 <td>Blablaine</td> | |
| 685 <td>34</td> | |
| 686 <td>P92Z6W415 O2</td> | |
| 687 <td>147.1128</td> | |
| 688 <td>147.1128</td> | |
| 689 </tr> | |
| 690 </table> | |
| 691 </body> | |
| 692 </html> |
