name short t0set num nMapped nPastEnd nGenic nUsed gMed gMedt0 gMean cor12 mad12 mad12c mad12c_t0 opcor adjcor gccor maxFit u set1IT049 Nickel (II) chloride 0.5 mM 3/5/2015 AzoBra_ML2a_set1 1 6422448 10147 3871203 3866821 493 1727 800.087109455825 0.157832843454169 0.208225175859921 1.31808602859297 1.3056099253789 0.128330462632153 0.0471240819640004 0.0172974825476408 3.07266810085209 TRUE set1IT050 copper (II) chloride 2 mM 3/5/2015 AzoBra_ML2a_set1 2 5972516 8481 3597856 3593973 447 1727 743.631905648665 0.216108212232703 0.216248140074222 1.33469539096124 1.3056099253789 0.145741660236755 0.00328165499237989 0.0200724795954949 1.72714513511723 TRUE set1IT051 Thallium(I) acetate 0.008 mg/ml 3/5/2015 AzoBra_ML2a_set1 3 6133237 9773 3698128 3694222 466 1727 764.374508586799 0.134744772238013 0.203995939318709 1.31431491077749 1.3056099253789 0.192377581728493 0.019621924045829 0.0121224208518687 1.47016793321608 TRUE set1IT052 LB 3/5/2015 AzoBra_ML2a_set1 4 5437071 8673 3274520 3271094 417 1727 676.824746534244 0.113497118191823 0.209152338513837 1.32369718774042 1.3056099253789 0.0919560904821418 0.0527844490673723 0.0240311215826683 1.58716218166499 TRUE set1IT053 nitrite 10 mM 3/5/2015 AzoBra_ML2a_set1 5 5327485 7745 3219024 3215627 412 1727 665.348024001655 0.16652028732346 0.214039903388758 1.3275746580285 1.3056099253789 0.157954777320886 0.0121767674737064 0.0325883996297299 1.23884022005804 TRUE set1IT054 nitrate 100 mM 3/5/2015 AzoBra_ML2a_set1 6 6733190 10513 4075385 4071060 508 1727 842.346368715084 0.194110260181014 0.212208138577993 1.3275746580285 1.3056099253789 0.187722386437921 -0.0382941994409024 -0.00494577826872929 1.49583779004077 TRUE set1IT055 Benzethonium chloride 0.003 mM 3/5/2015 AzoBra_ML2a_set1 7 6112840 8640 3714713 3710764 469 1727 767.797227394993 0.146247262504154 0.384125656161572 1.35979355730444 1.3056099253789 0.159280312761925 -0.00125435623479576 0.0222414673824005 2.72709897423102 TRUE set1IT056 Aluminum chloride 5 mM 3/5/2015 AzoBra_ML2a_set1 8 6405933 9207 3856382 3852222 485 1727 797.066418373681 0.148046628600666 0.202132407021592 1.29310525972161 1.3056099253789 0.173414154568269 0.0251442602496461 0.0322606148853566 1.61069549867339 TRUE set1IT057 benzoic 0.145 mg/ml 3/5/2015 AzoBra_ML2a_set1 9 5382947 8307 3245487 3242038 410 1727 670.8127457066 0.138078892766407 0.204235644524229 1.3245252063734 1.3056099253789 0.180477716401521 0.00396035835936366 0.0170129607832516 1.19474705518513 TRUE set1IT058 benzoic 0.29 mg/ml 3/5/2015 AzoBra_ML2a_set1 10 5935625 9112 3581114 3577212 457 1727 740.163873370577 0.13840746984489 0.209523961313449 1.31102148656525 1.3056099253789 0.100270502155631 0.0374520163182391 0.0256972573468168 1.50215669038049 TRUE set1IT059 Bacitracin 0.25 mg/ml 3/5/2015 AzoBra_ML2a_set1 11 5676809 8487 3426022 3422185 432 1727 708.087109455825 0.186182585035096 0.228227599954219 1.31634165986878 1.3056099253789 0.178094214482304 0.0226428476131158 0.00779057483037315 1.9355553078322 TRUE set1IT060 LB 3/5/2015 AzoBra_ML2a_set1 12 4951109 8154 2978321 2975058 376 1727 615.571694599628 0.155208037209428 0.205785402981109 1.31831684133498 1.3056099253789 0.192612593776234 0.0179006224076679 0.0069206230180215 1.58329288624319 TRUE set1IT061 Vancomycin 0.03 mg/ml 3/5/2015 AzoBra_ML2a_set1 13 6141004 9817 3705523 3701556 470 1727 765.89199255121 0.206033229855267 0.214130594306142 1.32277899142685 1.3056099253789 0.169464874694065 0.0179505907500852 0.00650979958257835 3.10021949174762 TRUE set1IT062 D-Cycloserine 0.125 mg/ml 3/5/2015 AzoBra_ML2a_set1 14 7174099 10126 4336890 4331807 546 1727 896.297744672046 0.150761876995202 0.399230278116303 1.33397213059234 1.3056099253789 0.0931921656324544 0.00344126656825223 -0.00943799541024723 4.45185962659803 TRUE set1IT063 Time0 3/5/2015 AzoBra_ML2a_set1 15 6111535 11051 3693571 3689655 467 1261 763.429546865301 0.00811673656651343 0.169741279895346 1.30065947813371 1.30459433167818 0.00783352302612214 0.0578171110227505 0.00724757786407937 1.16938500345261 FALSE set1IT064 Time0 3/5/2015 AzoBra_ML2a_set1 16 5567805 9711 3366624 3363118 424 1303 695.865507966067 -0.00834390343567939 0.168340746012063 1.30742852519225 1.29462074889163 -0.0532697536374917 0.0326383504714052 0.0267159430059895 1.09776355700862 FALSE set1IT065 Time0 3/5/2015 AzoBra_ML2a_set1 17 4932116 8706 2982352 2979215 376 1350 616.431822884337 0.00540822912141241 0.169861311950867 1.30061758864195 1.30263093581888 0.0462483326954184 0.00586305382362562 0.0106505984130751 1.23622981303718 FALSE set1IT066 Time0 3/5/2015 AzoBra_ML2a_set1 18 6002243 10469 3629615 3625812 456 1267 750.219739292365 0.00337581022435791 0.17073764501637 1.3252408289282 1.29364549924934 0.056526174079589 0.000730758594472559 -0.0395552368121196 1.17851432238712 FALSE set1IT067 D-Fructose (C) 3/5/2015 AzoBra_ML2a_set1 19 5677845 7682 3419246 3415504 429 1727 706.704738257811 0.253907975674329 0.193363452800798 1.32374166525929 1.3056099253789 0.247910446599632 0.126720899396895 0.0240787396987255 1.09609556247654 TRUE set1IT068 Sucrose (C) 3/5/2015 AzoBra_ML2a_set1 20 4863783 8245 2929670 2926460 373 1727 605.516242499483 0.238432639398556 0.195304178991982 1.30415339315939 1.3056099253789 0.209478513379542 0.0441893405986297 -0.0097962320708304 2.3950775731442 TRUE set1IT069 a-Ketoglutaric (C) 3/5/2015 AzoBra_ML2a_set1 21 5151000 6461 3115541 3112189 393 1727 643.945582453962 0.344377626753891 0.203028406387003 1.32736198093799 1.3056099253789 0.234986629181866 0.0393360738994055 0.0240113305895334 3.59843689679958 TRUE set1IT070 D-Fructose (C) 3/5/2015 AzoBra_ML2a_set1 22 5500060 7246 3314393 3310577 415 1727 684.994206497 0.245068105158824 0.198403919157716 1.28950661719499 1.3056099253789 0.226598516985737 0.0760058135995393 0.0222291396028463 1.31203760176875 TRUE set1IT071 Sucrose (C) 3/5/2015 AzoBra_ML2a_set1 23 4751344 12158 2849417 2846002 364 1727 588.868611628388 0.149986779943671 0.205331875725513 1.3172667175175 1.3056099253789 0.183157761271673 0.0406653124338052 -0.000660857008935749 3.51847328993362 TRUE set1IT072 a-Ketoglutaric (C) 3/5/2015 AzoBra_ML2a_set1 24 5092639 6242 3079485 3076163 380 1727 636.49141320091 0.320924380056191 0.204929918419082 1.29831389297716 1.3056099253789 0.239788471062651 0.0558884313364491 0.0164433598078407 3.81809314847504 TRUE set2IT001 D-Gluconic Acid (C) 3/5/2015 AzoBra_ML2a_set2 25 876463 1440 530552 530021 62 488 109.66708048831 0.220613925077455 0.411684859402434 1.37345839552744 1.29278174922785 0.178739616109491 0.0119016188658391 -0.00912962256356289 2.19556921397662 TRUE set2IT002 D-Lactate (C) 3/5/2015 AzoBra_ML2a_set2 26 3057132 5143 1839699 1837783 229 488 380.257190151045 0.168108524339093 0.213044250651925 1.29581525456823 1.29278174922785 0.197271762148145 0.0578443806699605 0.00331339859991613 1.49452256067585 TRUE set2IT003 L-Lactate (C) 3/5/2015 AzoBra_ML2a_set2 27 3188273 5508 1921566 1919589 239 488 397.183736809435 0.18918936199734 0.22111598683697 1.32672908115118 1.29278174922785 0.180170004611709 0.100841415973107 -0.00486788441310003 1.7160795110521 TRUE set2IT004 D,L-Lactate (C) 3/5/2015 AzoBra_ML2a_set2 28 2930806 4762 1768121 1766380 220 488 365.483136768053 0.154290552695975 0.223525348854644 1.30653604447038 1.29278174922785 0.164067683776983 0.0871677292669777 -0.00771409858039162 1.35613524409486 TRUE set2IT005 pyruvate (C) 3/5/2015 AzoBra_ML2a_set2 29 3055161 4912 1838482 1836610 230 488 380.0144837575 0.152972428628499 0.222295036124715 1.34680276352639 1.29278174922785 0.166406982676025 0.0577714686751509 0.0187995763024284 1.48315358086365 TRUE set2IT006 succinate (C) 3/5/2015 AzoBra_ML2a_set2 30 3711621 6644 2231625 2229315 278 488 461.26939788951 0.261681020354432 0.216613377073803 1.32192809488736 1.29278174922785 0.255998018351971 0.0406235763725175 -0.0106130304185894 1.23378955281802 TRUE set2IT007 Ethanol (C) 3/5/2015 AzoBra_ML2a_set2 31 3277796 5463 1974913 1972836 244 488 408.201117318436 0.167169653592108 0.21958795932594 1.3200409853431 1.29278174922785 0.187142400967643 0.0134445210205234 0.0265789193404055 1.59238435318744 TRUE set2IT008 Glycerol (C) 3/5/2015 AzoBra_ML2a_set2 32 3578332 5246 2192717 2190395 251 488 453.216428719222 0.304289700211703 0.230134921419807 1.30550254697425 1.29278174922785 0.245832060655635 0.0842647027717485 -6.02266770597814e-05 4.16620081757922 TRUE set2IT009 L-Malic (C) 3/5/2015 AzoBra_ML2a_set2 33 4178854 7487 2508144 2505837 311 488 518.484792054624 0.23871412794782 0.209664737244281 1.31975699584574 1.29278174922785 0.20115671111868 0.0735586846849794 -0.000537305409338188 1.48471121200637 TRUE set2IT010 L-Glutamine (C) 3/5/2015 AzoBra_ML2a_set2 34 3799378 4604 2290934 2288641 288 488 473.544589282019 0.20408855977472 0.204581851383208 1.32930762525296 1.29278174922785 0.193111730333631 0.0459501379492208 0.0195467627377537 1.64695901015287 TRUE set2IT011 L-Proline (C) 3/5/2015 AzoBra_ML2a_set2 35 3208984 4708 1932419 1930454 240 488 399.431822884337 0.249472600763557 0.214708080429959 1.31941687573131 1.29278174922785 0.244354626224068 0.09927242677812 0.00463523217698784 1.50084900078663 TRUE set2IT012 L-Alanine (C) 3/5/2015 AzoBra_ML2a_set2 36 551556 1346 334814 334324 40 488 69.1752534657563 0.040316991066336 1.45268673395428 1.83650126771712 1.29278174922785 0.0540275110527578 -0.0127530689574248 -0.0449249746208025 4.4380991890774 FALSE set2IT014 butyrate (C) 3/5/2015 AzoBra_ML2a_set2 38 3602031 6413 2171784 2169621 270 488 448.918063314711 0.171205544026585 0.217784943066972 1.32832586608551 1.29278174922785 0.224451047248343 0.0835556063921749 0.0134822610645263 2.23217790721463 TRUE set2IT015 L-Histidine (N) 3/5/2015 AzoBra_ML2a_set2 39 315562 464 190275 190076 24 488 39.3287812952617 0.106263751475029 0.556836409469883 1.29956028185891 1.29278174922785 0.0800196052575748 0.0320214577324246 0.00206173360941642 3.03720710164812 FALSE set2IT016 L-Lysine (N) 3/5/2015 AzoBra_ML2a_set2 40 3616705 5237 2181015 2178890 275 488 450.835919718601 0.273447655386354 0.22320635304751 1.32930762525296 1.29278174922785 0.236525460239629 0.123742267411626 0.0324882017026053 1.57710685847227 TRUE set2IT017 L-Aspartic Acid (N) 3/5/2015 AzoBra_ML2a_set2 41 3708515 5520 2232465 2230221 282 488 461.456859093731 0.216046615919881 0.21485823876431 1.336198191854 1.29278174922785 0.220226115522682 0.12502183280725 0.0428775858146128 1.7049801840986 TRUE set2IT018 L-Glutamic (N) 3/5/2015 AzoBra_ML2a_set2 42 2231867 2725 1345531 1343968 169 488 278.081522863646 0.163613160692845 0.41150356821719 1.38332863955151 1.29278174922785 0.109109596410195 0.0649474364684919 0.000625269853143084 4.283454459416 TRUE set2IT019 L-Serine (N) 3/5/2015 AzoBra_ML2a_set2 43 3844617 4959 2320718 2318163 295 488 479.653010552452 0.190085802877619 0.230878458612131 1.31932629969908 1.29278174922785 0.188669131282359 0.157044257551916 0.0450413088581822 3.41061538749935 TRUE set2IT020 L-Threonine (N) 3/5/2015 AzoBra_ML2a_set2 44 2774999 4076 1674957 1673153 211 488 346.193461618043 0.245907297296747 0.228865790088698 1.30666133823405 1.29278174922785 0.229592823487505 0.0909010925988199 0.0386034701390933 1.57641870903425 TRUE set2IT021 L-Asparagine (N) 3/5/2015 AzoBra_ML2a_set2 45 4035256 5641 2431894 2429606 308 488 502.71177322574 0.215370437312442 0.217796101375739 1.31160926651861 1.29278174922785 0.179640265049672 0.134724229854973 0.0207102362868653 1.40132234874224 TRUE set2IT022 Glycine (N) 3/5/2015 AzoBra_ML2a_set2 46 2737640 6446 1648786 1646876 204 488 340.75646596317 0.0806157259119867 0.463422037290165 1.37412430601279 1.29278174922785 0.084113650112675 0.0714449654977376 -0.017527640162472 2.23659390505453 FALSE set2IT024 L-Isoleucine (N) 3/5/2015 AzoBra_ML2a_set2 48 1078355 1545 655972 655315 76 488 135.591764949307 0.203208563463665 0.637812177859506 1.4671260104273 1.29278174922785 0.23316479021241 0.069656762425024 -0.0474803791269208 2.70726576930175 FALSE set2IT025 L-Leucine (N) 3/5/2015 AzoBra_ML2a_set2 49 3378340 4405 2043681 2041387 256 488 422.385061038692 0.227550670383701 0.249906452737749 1.34395440121736 1.29278174922785 0.140619855827249 0.102113660395903 0.00992680487984852 2.389115100073 TRUE set2IT026 L-Phenylalanine (N) 3/5/2015 AzoBra_ML2a_set2 50 3523388 4347 2126246 2124137 265 488 439.506931512518 0.172952025916414 0.24025199101121 1.31748218985617 1.29278174922785 0.194078962949772 0.111134864991722 0.0343299404770075 1.66914977279663 TRUE set2IT027 D-Alanine (N) 3/5/2015 AzoBra_ML2a_set2 51 3794423 10656 2283098 2280864 281 488 471.935443823712 0.296289186300604 0.222782507606875 1.34342916409829 1.29278174922785 0.294666238637142 0.109598430862359 0.0229057818082464 1.66858003298791 TRUE set2IT028 L-Citrulline (N) 3/5/2015 AzoBra_ML2a_set2 52 3284533 4218 1979445 1977384 253 488 409.142147734326 0.260196004900411 0.22694183878317 1.33239704148535 1.29278174922785 0.284342458185624 0.16196047911274 0.0322236085464121 1.70624119962597 TRUE set2IT029 casaminos (N) 3/5/2015 AzoBra_ML2a_set2 53 3408686 5531 2054730 2052611 262 488 424.70742809849 0.177403351281315 0.263268731624234 1.29545588352617 1.29278174922785 0.114515720725079 0.139293633305105 0.0389526034338157 1.67064088125629 TRUE set2IT030 Parabanic Acid (N) 3/5/2015 AzoBra_ML2a_set2 54 3369663 4447 2030466 2028334 254 488 419.684254086489 0.28796525229468 0.239860685335628 1.3416591714746 1.29278174922785 0.274428646499699 0.110413773443892 0.0321625162837397 1.48438740269171 TRUE set2IT031 Cytosine (N) 3/5/2015 AzoBra_ML2a_set2 55 4070678 6236 2450652 2448110 305 488 506.540451065591 0.312657795914329 0.230619395593116 1.33852460541806 1.29278174922785 0.275691355699653 0.085802698610027 0.0395213798900497 1.35777242941536 TRUE set2IT032 Glucuronamide (N) 3/5/2015 AzoBra_ML2a_set2 56 3432460 4305 2068592 2066516 265 488 427.584523070557 0.253892803686169 0.230699734653857 1.31702929547452 1.29278174922785 0.267303933598136 0.116341255876313 0.0332528646784686 1.5188695571575 TRUE set2IT033 Ammonium chloride (N) 3/5/2015 AzoBra_ML2a_set2 57 3329985 6624 2007311 2005377 253 488 414.934202358783 0.176138698683281 0.217256356286932 1.33520961599272 1.29278174922785 0.20619685124534 0.107201089774773 0.0370291912053747 1.77286757237249 TRUE set2IT034 nitrate (N) 3/5/2015 AzoBra_ML2a_set2 58 3583888 14808 2154887 2152510 267 488 445.377612249121 0.212365557778881 0.275456259751685 1.35264411510068 1.29278174922785 0.219083426666573 0.080045060733967 0.00938782944828545 2.17039868506255 TRUE set2IT035 Urea (N) 3/5/2015 AzoBra_ML2a_set2 59 3893843 5129 2349758 2347359 300 488 485.693978895096 0.258010709205769 0.209558851008268 1.34698901625918 1.29278174922785 0.230669256019565 0.126450719625873 0.0325373451411749 1.95176434144738 TRUE set2IT036 Time0 3/5/2015 AzoBra_ML2a_set2 60 3253254 5902 1963248 1961219 248 243 405.797434305814 0.0281530766453897 0.221447374922649 1.30895024088915 1.30433403487262 0.0229954510378051 0.0302955770460316 0.0263081309131922 1.78769834641753 FALSE set2IT037 Time0 3/5/2015 AzoBra_ML2a_set2 61 3198520 5769 1929323 1927418 243 248 398.803641630457 0.0281530766453897 0.221447374922649 1.30433403487262 1.30895024088915 0.0229954510378051 0.0302955770460316 -0.0263081309131922 1.73406763376218 FALSE set2IT038 Chloramphenicol 0.001 mg/ml 5/20/2015 AzoBra_ML2a_set2 62 3115613 3408 2230191 2228360 15 454 461.071798055038 0.0647556770728318 0.616301314873832 1.4594316186373 1.27871602806606 0.0895751981269894 0.0607623944535574 0.043929002453441 15.9041534293673 FALSE set2IT039 Tetracycline 0.00001 mg/ml 5/20/2015 AzoBra_ML2a_set2 63 3280534 1878 2005666 2003271 14 454 414.498448168839 0.041712945788238 1.08412644087673 2.20163386116965 1.27871602806606 0.0462129543813536 0.0016203820289619 -0.0278826681437184 14.2654193271943 FALSE set2IT040 Spectinomycin 0.02 mg/ml 5/20/2015 AzoBra_ML2a_set2 64 3050734 410 1983728 1983124 18 454 410.329815849369 0.0732910916558074 0.649386316219141 1.58496250072116 1.27871602806606 0.0682666764751708 0.0618762636309541 -0.0228746411696262 15.031159015258 FALSE set2IT041 Gentamicin 0.008 mg/ml 5/20/2015 AzoBra_ML2a_set2 65 3375146 6727 2069395 2065254 14 454 427.323401613904 0.088540742247463 0.825814876182932 1.8073549220576 1.27871602806606 0.0612501294270366 0.02880356086868 -0.0138126758712262 15.0422505311209 FALSE set2IT042 methylglyoxal 0.004 vol% 5/20/2015 AzoBra_ML2a_set2 66 3298799 494 2029228 2024056 18 454 418.799089592386 0.0324506882583838 0.669876846892524 1.67807190511264 1.27871602806606 0.0423339384136408 0.0573375242024469 0.00745703989226586 13.2108311596166 FALSE set2IT043 methylglyoxal 0.008 vol% 5/20/2015 AzoBra_ML2a_set2 67 3870133 2592 2403740 2402602 11 454 497.124353403683 0.0483623670710961 0.815710320272548 1.62449086490779 1.27871602806606 0.0334655332745916 -0.0100000123845658 -0.00199700699284438 13.4319830694668 FALSE set2IT044 methylglyoxal 0.016 vol% 5/20/2015 AzoBra_ML2a_set2 68 4056494 647 2307091 2299732 29 454 475.839437202566 0.0685595020244901 0.444954781366014 1.37851162325373 1.27871602806606 0.0684840027382673 0.0397238525162754 0.0444018350701069 8.73683337309295 FALSE set2IT045 2-Furfuraldehyde 0.03 vol% 5/20/2015 AzoBra_ML2a_set2 69 3816134 1081 2257433 2254721 36 454 466.526174218912 0.0632382663974822 0.623633962540441 1.92283213947754 1.27871602806606 0.0278094135084774 0.00670981206567054 0.0363625466780414 14.3342617138036 FALSE set2IT046 2-Furfuraldehyde 0.2 vol% 5/20/2015 AzoBra_ML2a_set2 70 2803136 4870 1684000 1680308 215 454 347.673908545417 0.110515840039215 0.319709958980765 1.32908788646023 1.27871602806606 0.138410560422346 0.0927414425614062 0.0787810819265838 1.78055572581442 TRUE set2IT047 Time0 5/20/2015 AzoBra_ML2a_set2 71 3019668 6210 1816539 1814207 231 221 375.379060624871 0.0565866790012959 0.233683372598406 1.28950661719499 1.27847498744977 0.131722446767773 0.0210709847011539 0.0454898648875905 1.95310125052005 FALSE set2IT048 Time0 5/20/2015 AzoBra_ML2a_set2 72 2906798 6087 1748596 1746401 221 231 361.349265466584 0.0565866790012959 0.233683372598406 1.27847498744977 1.28950661719499 0.131722446767773 0.0210709847011539 -0.0454898648875905 2.5791265830111 FALSE set3IT049 D-Gluconic Acid (C) 3/5/2015 AzoBra_ML2a_set3 73 4177360 5239 2529619 2527290 315 548 522.92364990689 0.347264023778964 0.212633808578026 1.32192809488736 1.30291479711689 0.220052192629152 0.087603472615522 0.057730861979537 2.20530800210027 TRUE set3IT050 D-Lactate (C) 3/5/2015 AzoBra_ML2a_set3 74 4190010 5835 2525882 2523495 320 548 522.138423339541 0.261312161970619 0.210406336444707 1.317678621886 1.30291479711689 0.273143654432735 0.13269219431539 0.0654575751885884 1.52810808020214 TRUE set3IT051 L-Lactate (C) 3/5/2015 AzoBra_ML2a_set3 75 4226169 6247 2545550 2542885 322 548 526.150424167184 0.29808091357114 0.200396023513346 1.29956028185891 1.30291479711689 0.280354674878563 0.185189066626878 0.0743466822841048 1.64561689293681 TRUE set3IT052 D,L-Lactate (C) 3/5/2015 AzoBra_ML2a_set3 76 3646058 4960 2200139 2197833 278 548 454.755431409063 0.244813069876342 0.223646283254182 1.30526962613453 1.30291479711689 0.261364149646479 0.161114678533878 0.074914765617403 2.00147524370804 TRUE set3IT053 pyruvate (C) 3/5/2015 AzoBra_ML2a_set3 77 3863413 5954 2330609 2328409 293 548 481.773018828885 0.276312355152449 0.211441696583944 1.32000748882485 1.30291479711689 0.27724860843911 0.101453667607347 0.0624732269091301 1.54439727727243 TRUE set3IT054 succinate (C) 3/5/2015 AzoBra_ML2a_set3 78 4008069 6686 2409541 2407067 304 548 498.048210221395 0.264798925074316 0.219578184826722 1.3252408289282 1.30291479711689 0.281684227189529 0.163384791313818 0.0641246166053976 1.95817706948651 TRUE set3IT055 Ethanol (C) 3/5/2015 AzoBra_ML2a_set3 79 4204440 6620 2535794 2533152 319 548 524.136561142148 0.275230492571343 0.215170935304995 1.33120590847537 1.30291479711689 0.325862435698169 0.151874347255963 0.0770591897877524 1.87526335558009 TRUE set3IT056 Glycerol (C) 3/5/2015 AzoBra_ML2a_set3 80 4242426 4985 2585032 2582447 310 548 534.336230084833 0.343710661992492 0.216067266277689 1.30812229536233 1.30291479711689 0.279159376133782 0.179533871495293 0.0728419637105338 3.30923431425251 TRUE set3IT057 L-Malic (C) 3/5/2015 AzoBra_ML2a_set3 81 3946076 6735 2373566 2371236 299 548 490.634388578523 0.300713381783372 0.217271169012541 1.31303310084223 1.30291479711689 0.272194898353547 0.162045184029197 0.0643720722489591 1.70444380637855 TRUE set3IT058 L-Glutamine (C) 3/5/2015 AzoBra_ML2a_set3 82 3787652 5259 2287777 2285503 290 548 472.895303124353 0.304977988131532 0.207246242946378 1.31389077582194 1.30291479711689 0.279885995222499 0.130063479624057 0.0699469298852085 2.4079726678897 TRUE set3IT059 L-Proline (C) 3/5/2015 AzoBra_ML2a_set3 83 4046231 5466 2442364 2439865 308 548 504.834471342851 0.296525514653726 0.207677779530816 1.31090909392721 1.30291479711689 0.269143838701509 0.13958467170878 0.0804411470762707 1.70584069851506 TRUE set3IT060 L-Alanine (C) 3/5/2015 AzoBra_ML2a_set3 84 901751 1552 549453 548944 63 548 113.582453962342 0.075604337862744 1.10891062409165 1.66296501272243 1.30291479711689 0.139379650083751 -0.0202991086501853 -0.00161529421268153 4.89595518307049 FALSE set3IT061 L-Leucine (C) 3/5/2015 AzoBra_ML2a_set3 85 4013190 4892 2435263 2433087 296 548 503.432029795158 0.264138992917314 0.211905846201847 1.32659953461126 1.30291479711689 0.148188130930891 0.0815603839153519 0.0425873039510547 2.02701456093082 TRUE set3IT062 butyrate (C) 3/5/2015 AzoBra_ML2a_set3 86 4721849 7538 2850950 2847930 361 548 589.267535692117 0.249228676403009 0.207521465608385 1.29817949211475 1.30291479711689 0.258748680212944 0.133100520736572 0.0623641842614332 1.50961708395896 TRUE set3IT063 L-Histidine (N) 3/5/2015 AzoBra_ML2a_set3 87 3223527 4797 1943894 1941785 245 548 401.776329402028 0.143549530658646 0.327431929361289 1.33880191345176 1.30291479711689 0.112779423965657 0.109408241603298 0.0484253718152458 3.95674331892198 TRUE set3IT064 L-Lysine (N) 3/5/2015 AzoBra_ML2a_set3 88 3655794 5061 2199722 2197528 276 548 454.692323608525 0.295659280008959 0.207275316374674 1.31146109583629 1.30291479711689 0.268253095656612 0.189171642779255 0.0666380027156214 1.64652299593266 TRUE set3IT065 L-Aspartic Acid (N) 3/5/2015 AzoBra_ML2a_set3 89 3024394 4132 1821400 1819458 230 548 376.465549348231 0.255665718437219 0.227809095467364 1.32610377085856 1.30291479711689 0.264611057443876 0.119861506674812 0.0776658050520737 1.88659272203979 TRUE set3IT066 L-Glutamic (N) 3/5/2015 AzoBra_ML2a_set3 90 1466882 1819 888036 887218 111 548 183.575005172771 0.140080094878669 0.571611697851755 1.40284809027093 1.30291479711689 0.154134424142594 0.0884439948903685 0.0182890501447552 4.22778323674643 FALSE set3IT067 L-Serine (N) 3/5/2015 AzoBra_ML2a_set3 91 3664761 4700 2214128 2211765 278 548 457.638112973309 0.185916511070541 0.233459584092581 1.31070083946411 1.30291479711689 0.182896157840528 0.0912061242902025 0.0705330218631225 3.00392570241112 TRUE set3IT068 L-Threonine (N) 3/5/2015 AzoBra_ML2a_set3 92 2240795 3863 1351971 1350596 168 548 279.452927788123 0.11197174009839 0.35576082791158 1.34283708465034 1.30291479711689 0.125184943564896 0.0859891040698909 0.0420027758922793 2.94039331702887 TRUE set3IT069 L-Asparagine (N) 3/5/2015 AzoBra_ML2a_set3 93 3252353 4187 1962966 1960994 248 548 405.750879370991 0.25210181363983 0.215281584311508 1.32847094075414 1.30291479711689 0.235726574429637 0.10935866460892 0.0460485110884949 1.55595449602614 TRUE set3IT070 Glycine (N) 3/5/2015 AzoBra_ML2a_set3 94 1537000 3520 924599 923597 111 548 191.102213945789 0.0760660605324687 0.632108104641263 1.44805255650681 1.30291479711689 0.0587902067744665 0.0518871760341831 0.0247236741127161 2.70955957486429 FALSE set3IT072 L-Isoleucine (N) 3/5/2015 AzoBra_ML2a_set3 96 1854107 2631 1127975 1126956 134 548 233.179391682185 0.191806833444707 0.471157176014614 1.40335569423121 1.30291479711689 0.168875344132369 0.0148923203696201 -0.0034312512114819 2.60917436364402 TRUE set3IT073 L-Leucine (N) 3/5/2015 AzoBra_ML2a_set3 97 2835503 3841 1716266 1714359 213 548 354.719428926133 0.258831920087498 0.259022793376571 1.33441903907056 1.30291479711689 0.173486555003265 0.034800735930976 0.0433342732162587 2.51361016747646 TRUE set3IT074 L-Phenylalanine (N) 3/5/2015 AzoBra_ML2a_set3 98 2223116 2644 1341267 1339964 170 548 277.253051934616 0.16626748772536 0.245344941120709 1.3112016882943 1.30291479711689 0.135505451345075 0.0970473162321468 0.0612561723060323 1.85013198805262 TRUE set3IT075 D-Alanine (N) 3/5/2015 AzoBra_ML2a_set3 99 3040648 6930 1830799 1828956 228 548 378.43078833023 0.292009382047386 0.222550395065958 1.32832586608551 1.30291479711689 0.285060374445454 0.163437380747329 0.047242811658515 1.43228645490254 TRUE set3IT076 L-Citrulline (N) 3/5/2015 AzoBra_ML2a_set3 100 3727831 4803 2249455 2247154 285 548 464.960480033106 0.243977924787956 0.213580265322898 1.33257533908687 1.30291479711689 0.246026761554655 0.0996020079511936 0.0677924787151851 1.37016752987525 TRUE set3IT077 casaminos (N) 3/5/2015 AzoBra_ML2a_set3 101 2602165 3936 1571361 1569836 201 548 324.816056279743 0.121092831228748 0.32010022181364 1.31602749344768 1.30291479711689 0.156173826205915 0.0423176361125598 0.0556104907724874 2.09692828225087 TRUE set3IT078 Parabanic Acid (N) 3/5/2015 AzoBra_ML2a_set3 102 3762614 4599 2267646 2265411 281 548 468.738050900062 0.307288675512993 0.223007089873055 1.34872815423108 1.30291479711689 0.250403699458954 0.0928542441012026 0.057065729876247 1.74389927158132 TRUE set3IT079 Cytosine (N) 3/5/2015 AzoBra_ML2a_set3 103 4609275 5746 2781778 2778912 348 548 574.98696461825 0.376831014029282 0.201177911228511 1.31315788525963 1.30291479711689 0.294171859895336 0.134401746439438 0.0641101928353995 1.62360906735499 TRUE set3IT080 Glucuronamide (N) 3/5/2015 AzoBra_ML2a_set3 104 3539723 4153 2134554 2132299 271 548 441.195737637078 0.241528419887564 0.228351976037161 1.30875270613963 1.30291479711689 0.264443268473317 0.109842498278067 0.0788186493196637 1.50253565418942 TRUE set3IT081 Ammonium chloride (N) 3/5/2015 AzoBra_ML2a_set3 105 3191036 5065 1923494 1921629 246 548 397.605834885164 0.199994174771671 0.205419123435656 1.30116953472057 1.30291479711689 0.181001069192507 0.112680165818194 0.069161197794968 1.51806788700907 TRUE set3IT082 nitrate (N) 3/5/2015 AzoBra_ML2a_set3 106 3696676 6738 2232312 2230153 283 548 461.442789157873 0.241524872586918 0.206033194484438 1.30515988150647 1.30291479711689 0.264832806259971 0.0986226878345489 0.044923167890807 1.37419167929524 TRUE set3IT083 Urea (N) 3/5/2015 AzoBra_ML2a_set3 107 3661296 5221 2210589 2208379 282 548 456.937512931926 0.278850803996931 0.199721345148659 1.30545445473494 1.30291479711689 0.257767551910168 0.121428512471793 0.0510576725973708 1.55571657678913 TRUE set3IT084 Time0 3/5/2015 AzoBra_ML2a_set3 108 3637342 6474 2194668 2192397 277 271 453.630664183737 0.187949535919864 0.198572664431393 1.31410859042806 1.30975338094126 0.213443693312787 0.131065151553677 0.105686797541469 1.99958436031777 FALSE set3IT085 Time0 3/5/2015 AzoBra_ML2a_set3 109 3660079 6587 2207052 2204825 271 277 456.202151872543 0.187949535919864 0.198572664431393 1.30975338094126 1.31410859042806 0.213443693312787 0.131065151553677 -0.105686797541469 1.90673250989617 FALSE set3IT086 5-Hydroxymethylfurfural 2.5 mM 5/20/2015 AzoBra_ML2a_set3 110 3199463 4476 1909828 1906723 13 527 394.52162218084 0.0737734514955371 0.936562138288355 2 1.29490492112082 0.0721429301161517 0.0548514938923646 0.00289738087939521 14.1934036321113 FALSE set3IT087 5-Hydroxymethylfurfural 5 mM 5/20/2015 AzoBra_ML2a_set3 111 3565963 5320 2172233 2168392 30 527 448.663769915167 0.0906559213287425 0.695396460307147 2 1.29490492112082 0.1058477286497 -0.000289172329714336 0.0410192911817872 13.8281814982384 FALSE set3IT088 Furfuryl Alcohol 0.2 vol% 5/20/2015 AzoBra_ML2a_set3 112 2605664 3891 1598875 1597868 11 527 330.616180426236 0.0599404067884972 0.93967662467431 1.87446911791614 1.29490492112082 0.0715932332528277 0.0627178055843093 0.016770306338239 14.4231607826646 FALSE set3IT089 LB 5/20/2015 AzoBra_ML2a_set3 113 2787530 2392 1683608 1681975 14 527 348.018828884751 0.0877446047731761 0.864343869875536 1.87446911791614 1.29490492112082 0.0422436808554173 0.0139790680580498 0.00648494108567279 13.7951281440232 FALSE set3IT090 Choline chloride 100 mM 5/20/2015 AzoBra_ML2a_set3 114 2553927 12586 1956188 1955655 36 527 404.646182495345 0.137098986004541 0.458424515405146 1.41503749927884 1.29490492112082 0.166420485552448 0.125835037335797 0.0528068708597581 14.980453600238 FALSE set3IT091 Cholin acetate 25 mM 5/20/2015 AzoBra_ML2a_set3 115 3538354 11747 2103697 2100741 22 527 434.666045934202 0.0746086520618635 1.25792220082613 2.54432051622381 1.29490492112082 0.0356241693878185 0.0356601120841106 0.0254510891074763 13.2471049186819 FALSE set3IT092 1-ethyl-3-methylimidazolium chloride 20 mM 5/20/2015 AzoBra_ML2a_set3 116 3445749 6271 2003185 2000551 63 527 413.935650734533 0.0727773791379624 0.891237047945025 2.36923380966572 1.29490492112082 0.0119840791077431 0.0659830183524496 0.0139762839404383 11.9488484763243 FALSE set3IT093 L-Lysine 40 mM 5/20/2015 AzoBra_ML2a_set3 117 2374100 319 1887078 1886953 13 527 390.430995241051 0.0788881212329922 0.62250172919544 1.32192809488736 1.29490492112082 0.127202182805911 0.0858466560649562 0.0310148267195018 16.9364842688134 FALSE set3IT094 LB 5/20/2015 AzoBra_ML2a_set3 118 3307547 3662 2045795 2043495 13 527 422.821229050279 0.0756155056702849 1.10806085614494 2.16992500144231 1.29490492112082 0.0378456081048699 0.0184596290640725 0.00404101986275448 14.423110997206 FALSE set3IT095 Time0 5/20/2015 AzoBra_ML2a_set3 119 3474781 6978 2088524 2086038 262 265 431.623836126629 0.0594887385986617 0.216047438743472 1.32192809488736 1.29661700635817 0.0813455132149205 0.0297467257547908 0.0621264219235592 2.14488816014295 FALSE set3IT096 Time0 5/20/2015 AzoBra_ML2a_set3 120 3515507 7170 2112515 2110008 265 262 436.583488516449 0.0594887385986617 0.216047438743472 1.29661700635817 1.32192809488736 0.0813455132149205 0.0297467257547908 -0.0621264219235591 1.68999062068446 FALSE set4IT001 Cobalt chloride 0.2 mM 5/20/2015 AzoBra_ML2a_set4 121 2860011 5154 1718714 1716419 211 600 355.145665218291 0.255146975011179 0.314806938733228 1.32915966411844 1.31243664591006 0.27389079738008 0.153771570460151 -0.0567487806287984 5.60398842455515 TRUE set4IT002 Cobalt chloride 0.3 mM 5/20/2015 AzoBra_ML2a_set4 122 3421292 6138 2055870 2053091 245 600 424.806745292779 0.168385300046069 0.315039024152456 1.33347214712277 1.31243664591006 0.197872652711299 0.0326666459188761 -0.00684476287460372 6.81844731343042 TRUE set4IT003 Paraquat dichloride 0.02 mg/ml 5/20/2015 AzoBra_ML2a_set4 123 3901560 6731 2345024 2342234 295 600 484.633560935237 0.198318466066206 0.335359410446255 1.32267348113018 1.31243664591006 0.2241917747074 0.0251518621417734 -0.00511323736917385 4.50586562621437 TRUE set4IT004 Paraquat dichloride 0.04 mg/ml 5/20/2015 AzoBra_ML2a_set4 124 3685363 6499 2219699 2216623 277 600 458.643285743844 0.202931787701914 0.375887580510449 1.35255971354103 1.31243664591006 0.226360750865708 0.0364310531096932 -0.00817235753784937 4.8617295270576 TRUE set4IT005 Cisplatin 0.005 mg/ml 5/20/2015 AzoBra_ML2a_set4 125 3732905 5871 2242037 2238769 280 600 463.225532795365 0.145024652990139 0.638813865424313 1.48062584090642 1.31243664591006 0.061883204323074 -0.0151235546485423 -0.0412400186229908 4.27228285430316 FALSE set4IT006 Sisomicin 0.01 mg/ml 5/20/2015 AzoBra_ML2a_set4 126 4284951 7514 2574794 2571515 326 600 532.074280984895 0.144411096128504 0.415554491353354 1.40008715781287 1.31243664591006 0.192866886763187 0.0323400793065714 0.00995310606405559 5.27611783201327 TRUE set4IT007 Sisomicin 0.015 mg/ml 5/20/2015 AzoBra_ML2a_set4 127 3684005 6121 2219365 2216682 279 600 458.655493482309 0.145508118800254 0.511445453727095 1.40498383461492 1.31243664591006 0.133898722081985 0.0129618724365053 -0.034363938738234 6.41163840594495 FALSE set4IT008 Sisomicin 0.02 mg/ml 5/20/2015 AzoBra_ML2a_set4 128 3957704 7237 2364272 2360243 289 600 488.359817918477 0.102800628255193 0.84652838907241 1.60445867634695 1.31243664591006 0.0686952986444731 -0.0475719004093387 -0.0291603182388401 7.7559433376495 FALSE set4IT009 LB 5/20/2015 AzoBra_ML2a_set4 129 4116888 7119 2470856 2467328 310 600 510.516863231947 0.152387609733414 0.393267610088088 1.37419540450434 1.31243664591006 0.176150848423227 0.0337476765962171 -0.0240989936659271 5.54157401251647 TRUE set4IT010 Chlorite 1 mM 5/20/2015 AzoBra_ML2a_set4 130 3407129 5981 2039393 2036572 258 600 421.388785433478 0.203919543809891 0.317161024530852 1.35584586611361 1.31243664591006 0.229283663481079 0.0426229111699532 -0.0206627040252538 4.57322664041051 TRUE set4IT011 Polymyxin B sulfate 0.04 mg/ml 5/20/2015 AzoBra_ML2a_set4 131 2634112 333217 1652017 1651140 6 600 341.638733705773 0.0233441232784747 0.697741562945406 1.22239242133645 1.31243664591006 0.0503067521065395 0.0467653847820789 -0.0223186273126347 15.8639882545092 FALSE set4IT012 Polymyxin B sulfate 0.06 mg/ml 5/20/2015 AzoBra_ML2a_set4 132 2454254 308 1655859 1608317 8 600 332.778191599421 0.0177043583905643 0.651192271038401 1.22239242133645 1.31243664591006 0.101084723946979 0.0327427204735491 -0.0292035114753759 15.1958088497927 FALSE set4IT013 Chloride 350 mM 5/20/2015 AzoBra_ML2a_set4 133 3402320 6643 2052891 2049822 257 600 424.130353817505 0.0243378291890013 0.439008324517744 1.35147237050138 1.31243664591006 0.0630231841574438 0.0452668703562283 0.0115891688665659 3.09383373231526 FALSE set4IT014 LB 5/20/2015 AzoBra_ML2a_set4 134 2877252 5589 1718888 1716697 218 600 355.20318642665 0.173293939851632 0.380778227245138 1.36923380966572 1.31243664591006 0.159686408233363 0.0534299114844445 -0.0123121872003377 4.87619972043569 TRUE set4IT015 Time0 5/20/2015 AzoBra_ML2a_set4 135 3022031 6285 1821683 1819506 230 368 376.47548106766 0.00916899370577432 0.208599205221921 1.29956028185891 1.29932666595023 -0.0273658825718331 0.00712470961698949 -0.00191271847234757 1.80682499798645 FALSE set4IT016 Time0 5/20/2015 AzoBra_ML2a_set4 136 4877026 9910 2937277 2933885 368 230 607.052555348645 0.00916899370577432 0.208599205221921 1.29932666595023 1.29956028185891 -0.0273658825718331 0.00712470961698949 0.00191271847234752 2.96652300769624 FALSE set4IT017 outer cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 137 2848397 4199 1745597 1743577 194 600 360.764949306849 0.242690225541699 0.579764577319204 1.45836493094294 1.31243664591006 0.270562634311644 0.0380768107976631 0.0225306680661667 6.19277197169325 FALSE set4IT018 outer cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 138 3382075 5373 2061133 2058518 235 600 425.929650320712 0.244003688002332 0.495784865392348 1.40335569423121 1.31243664591006 0.193648940397676 0.0581091770472565 -0.0114592185648748 5.5906415417949 TRUE set4IT019 outer cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 139 2957609 4971 1789939 1787797 207 600 369.914545830747 0.19674416487454 0.565612831812609 1.45567948377619 1.31243664591006 0.157193736990288 0.03736848255753 -0.00233665663772802 5.48220189347138 FALSE set4IT020 outer cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 140 3407587 4410 2079005 2076881 231 600 429.72915373474 0.219767003244651 0.607909078108483 1.45798964446339 1.31243664591006 0.234729341170438 0.0373435035198104 -0.000458197517184466 6.13718224749329 FALSE set4IT021 inner cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 141 3410695 5357 2062960 2060126 246 600 426.262362921581 0.166936729637287 0.418967603655627 1.42551229286848 1.31243664591006 0.111766178129172 -0.0109436582397107 -0.0157404946925782 4.75496501507679 TRUE set4IT022 inner cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 142 3142675 5564 1886754 1884369 236 600 389.896337678461 0.175638158951735 0.396710982842517 1.39071542765959 1.31243664591006 0.148522453003754 0.0214351304352514 -0.0317778335962637 3.82052926481233 TRUE set4IT023 inner cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 143 2171716 3437 1302523 1300753 157 600 269.139871715291 0.153726714110149 0.476185910161287 1.40275916950041 1.31243664591006 0.112341216357282 0.0156128360342493 -0.0535164265058491 4.54633963344909 TRUE set4IT024 inner cut, LB soft agar motility assay 5/20/2015 AzoBra_ML2a_set4 144 3176911 5236 1913778 1911634 231 600 395.537761224912 0.156997332853649 0.508986201711864 1.4594316186373 1.31243664591006 0.184037402224919 0.0618110587788126 -0.0385917203775256 4.73770496825899 FALSE