comparison caret_future/tool3/test/output @ 0:a4a2ad5a214e draft default tip

Uploaded

0:a4a2ad5a214e

"COMPOUND"	"Active"	"Inactive"	"PREDICTED ACTIVITY"
"ZINC03815630"	"0.6605116"	"0.3394884"	" Active "
"ZINC03815642"	"0.6995959"	"0.3004041"	" Active "
"ZINC03815643"	"0.6562579"	"0.3437421"	" Active "
"ZINC03815648"	"0.6554278"	"0.3445722"	" Active "
"ZINC03815651"	"0.5831073"	"0.4168927"	" Active "
"ZINC03831999"	"0.6084293"	"0.3915707"	" Active "
"ZINC03833842"	"0.6860271"	"0.3139729"	" Active "
"ZINC03833846"	"0.3396242"	"0.6603758"	"Inactive"
"ZINC03833856"	"0.7416464"	"0.2583536"	" Active "
"ZINC03833860"	"0.5976322"	"0.4023678"	" Active "
"ZINC00626142"	"0.2684012"	"0.7315988"	"Inactive"
"ZINC00629927"	"0.2638824"	"0.7361176"	"Inactive"
"ZINC00634874"	"0.2738968"	"0.7261032"	"Inactive"
"ZINC00637847"	"0.2526287"	"0.7473713"	"Inactive"
"ZINC00645607"	"0.2910792"	"0.7089208"	"Inactive"
"ZINC00648071"	"0.2824657"	"0.7175343"	"Inactive"
"ZINC00650476"	"0.2858537"	"0.7141463"	"Inactive"
"ZINC00650893"	"0.2884920"	"0.7115080"	"Inactive"
"ZINC00654693"	"0.2543801"	"0.7456199"	"Inactive"
"ZINC00656564"	"0.2415392"	"0.7584608"	"Inactive"
"ZINC00658274"	"0.2302122"	"0.7697878"	"Inactive"
"ZINC00667976"	"0.2526746"	"0.7473254"	"Inactive"
"ZINC00671476"	"0.3306144"	"0.6693856"	"Inactive"
"ZINC00674038"	"0.2782337"	"0.7217663"	"Inactive"
"ZINC00676709"	"0.3563468"	"0.6436532"	"Inactive"
"ZINC00687389"	"0.2666435"	"0.7333565"	"Inactive"
"ZINC00688216"	"0.2765941"	"0.7234059"	"Inactive"
"ZINC00694048"	"0.2880697"	"0.7119303"	"Inactive"
"ZINC00695436"	"0.2570054"	"0.7429946"	"Inactive"
"ZINC00695438"	"0.2570054"	"0.7429946"	"Inactive"
"ZINC00695608"	"0.2758491"	"0.7241509"	"Inactive"
"ZINC00695768"	"0.2596723"	"0.7403277"	"Inactive"
"ZINC00703647"	"0.2938489"	"0.7061511"	"Inactive"
"ZINC00704218"	"0.2669295"	"0.7330705"	"Inactive"
"ZINC00706294"	"0.2579063"	"0.7420937"	"Inactive"
"ZINC00718343"	"0.2587215"	"0.7412785"	"Inactive"
"ZINC00718344"	"0.2739405"	"0.7260595"	"Inactive"
"ZINC00718867"	"0.3189602"	"0.6810398"	"Inactive"
"ZINC00738966"	"0.3186994"	"0.6813006"	"Inactive"
"ZINC00760093"	"0.2720093"	"0.7279907"	"Inactive"
"ZINC00764069"	"0.2823171"	"0.7176829"	"Inactive"
"ZINC00764216"	"0.2811749"	"0.7188251"	"Inactive"
"ZINC00774052"	"0.2786257"	"0.7213743"	"Inactive"
"ZINC00776421"	"0.2435838"	"0.7564162"	"Inactive"
"ZINC00776446"	"0.2769139"	"0.7230861"	"Inactive"
"ZINC00843834"	"0.2722041"	"0.7277959"	"Inactive"
"ZINC00849513"	"0.2649136"	"0.7350864"	"Inactive"
"ZINC00853141"	"0.2774844"	"0.7225156"	"Inactive"
"ZINC00863883"	"0.2726998"	"0.7273002"	"Inactive"
"ZINC00865555"	"0.2573042"	"0.7426958"	"Inactive"
"ZINC00868821"	"0.2796341"	"0.7203659"	"Inactive"
"ZINC00868996"	"0.2749553"	"0.7250447"	"Inactive"
"ZINC00868997"	"0.2822468"	"0.7177532"	"Inactive"
"ZINC00877701"	"0.2846944"	"0.7153056"	"Inactive"
"ZINC00877703"	"0.2707994"	"0.7292006"	"Inactive"
"ZINC00882544"	"0.2814341"	"0.7185659"	"Inactive"
"ZINC00890200"	"0.2606811"	"0.7393189"	"Inactive"
"ZINC00912438"	"0.2894036"	"0.7105964"	"Inactive"
"ZINC00914250"	"0.2833188"	"0.7166812"	"Inactive"
"ZINC00915795"	"0.2682290"	"0.7317710"	"Inactive"
"ZINC00915898"	"0.3048733"	"0.6951267"	"Inactive"
"ZINC00918463"	"0.2444205"	"0.7555795"	"Inactive"
"ZINC00925392"	"0.2783228"	"0.7216772"	"Inactive"
"ZINC00925444"	"0.2722545"	"0.7277455"	"Inactive"
"ZINC00928830"	"0.2646057"	"0.7353943"	"Inactive"
"ZINC00929235"	"0.2980306"	"0.7019694"	"Inactive"
"ZINC00929384"	"0.2753183"	"0.7246817"	"Inactive"
"ZINC00929957"	"0.2691465"	"0.7308535"	"Inactive"
"ZINC00930465"	"0.2924419"	"0.7075581"	"Inactive"
"ZINC00930466"	"0.2990807"	"0.7009193"	"Inactive"
"ZINC00930583"	"0.2389700"	"0.7610300"	"Inactive"
"ZINC00933050"	"0.2619174"	"0.7380826"	"Inactive"
"ZINC00933324"	"0.2576179"	"0.7423821"	"Inactive"
"ZINC00934007"	"0.2659721"	"0.7340279"	"Inactive"
"ZINC00937492"	"0.2882481"	"0.7117519"	"Inactive"
"ZINC00944190"	"0.2817535"	"0.7182465"	"Inactive"
"ZINC00961460"	"0.2746976"	"0.7253024"	"Inactive"
"ZINC00962181"	"0.2958487"	"0.7041513"	"Inactive"
"ZINC00989406"	"0.2881123"	"0.7118877"	"Inactive"
"ZINC01001407"	"0.2525426"	"0.7474574"	"Inactive"
"ZINC01020873"	"0.2679308"	"0.7320692"	"Inactive"
"ZINC01057945"	"0.2658515"	"0.7341485"	"Inactive"
"ZINC01058141"	"0.3114972"	"0.6885028"	"Inactive"
"ZINC01058143"	"0.3114972"	"0.6885028"	"Inactive"
"ZINC01058145"	"0.3114972"	"0.6885028"	"Inactive"
"ZINC01064791"	"0.2565423"	"0.7434577"	"Inactive"
"ZINC01070295"	"0.2678792"	"0.7321208"	"Inactive"
"ZINC01073446"	"0.2624896"	"0.7375104"	"Inactive"
"ZINC01077958"	"0.3206186"	"0.6793814"	"Inactive"
"ZINC01079564"	"0.2451854"	"0.7548146"	"Inactive"
"ZINC01084391"	"0.2572880"	"0.7427120"	"Inactive"
"ZINC01088121"	"0.2674156"	"0.7325844"	"Inactive"
"ZINC01090925"	"0.2556056"	"0.7443944"	"Inactive"
"ZINC01092304"	"0.2721695"	"0.7278305"	"Inactive"
"ZINC01094297"	"0.2537718"	"0.7462282"	"Inactive"
"ZINC01097883"	"0.2820411"	"0.7179589"	"Inactive"
"ZINC01103996"	"0.2365332"	"0.7634668"	"Inactive"
"ZINC01109312"	"0.2854654"	"0.7145346"	"Inactive"
"ZINC01113505"	"0.2510556"	"0.7489444"	"Inactive"
"ZINC01118377"	"0.2740795"	"0.7259205"	"Inactive"
"ZINC01119063"	"0.2836198"	"0.7163802"	"Inactive"
"ZINC01128877"	"0.3002824"	"0.6997176"	"Inactive"
"ZINC01130304"	"0.2703695"	"0.7296305"	"Inactive"
"ZINC01131685"	"0.2632475"	"0.7367525"	"Inactive"
"ZINC01143087"	"0.2664249"	"0.7335751"	"Inactive"
"ZINC01143476"	"0.2754909"	"0.7245091"	"Inactive"
"ZINC01145016"	"0.2995920"	"0.7004080"	"Inactive"
"ZINC01159095"	"0.2547323"	"0.7452677"	"Inactive"
"ZINC01188088"	"0.2715412"	"0.7284588"	"Inactive"
"ZINC01200944"	"0.2915643"	"0.7084357"	"Inactive"
"ZINC01206103"	"0.2597720"	"0.7402280"	"Inactive"
"ZINC01208391"	"0.2674336"	"0.7325664"	"Inactive"
"ZINC01212864"	"0.2548999"	"0.7451001"	"Inactive"
"ZINC01222264"	"0.2873613"	"0.7126387"	"Inactive"
"ZINC01223709"	"0.3000712"	"0.6999288"	"Inactive"
"ZINC01250394"	"0.2725467"	"0.7274533"	"Inactive"
"ZINC01289245"	"0.2382167"	"0.7617833"	"Inactive"
"ZINC01302345"	"0.2748519"	"0.7251481"	"Inactive"
"ZINC01314921"	"0.3038091"	"0.6961909"	"Inactive"
"ZINC01325286"	"0.3122430"	"0.6877570"	"Inactive"
"ZINC01328987"	"0.2121218"	"0.7878782"	"Inactive"
"ZINC01433613"	"0.2793041"	"0.7206959"	"Inactive"
"ZINC01437595"	"0.2753145"	"0.7246855"	"Inactive"
"ZINC01474436"	"0.2618280"	"0.7381720"	"Inactive"
"ZINC01474519"	"0.2674420"	"0.7325580"	"Inactive"
"ZINC01474589"	"0.2628228"	"0.7371772"	"Inactive"
"ZINC01474597"	"0.2699547"	"0.7300453"	"Inactive"
"ZINC01474670"	"0.2570312"	"0.7429688"	"Inactive"
"ZINC01474726"	"0.2719588"	"0.7280412"	"Inactive"
"ZINC01474801"	"0.2737998"	"0.7262002"	"Inactive"
"ZINC01474809"	"0.2658977"	"0.7341023"	"Inactive"
"ZINC01474913"	"0.2705071"	"0.7294929"	"Inactive"
"ZINC01474914"	"0.2705071"	"0.7294929"	"Inactive"
"ZINC01474941"	"0.2679127"	"0.7320873"	"Inactive"
"ZINC01475076"	"0.2713837"	"0.7286163"	"Inactive"
"ZINC01475084"	"0.2652470"	"0.7347530"	"Inactive"
"ZINC01477481"	"0.2732718"	"0.7267282"	"Inactive"
"ZINC01478327"	"0.2725018"	"0.7274982"	"Inactive"
"ZINC01478407"	"0.2613246"	"0.7386754"	"Inactive"
"ZINC01479282"	"0.2621951"	"0.7378049"	"Inactive"
"ZINC01479302"	"0.2584039"	"0.7415961"	"Inactive"
"ZINC01479306"	"0.2641722"	"0.7358278"	"Inactive"
"ZINC01479361"	"0.2785454"	"0.7214546"	"Inactive"
"ZINC01479528"	"0.2670949"	"0.7329051"	"Inactive"
"ZINC01479559"	"0.2667573"	"0.7332427"	"Inactive"
"ZINC01479574"	"0.2646665"	"0.7353335"	"Inactive"
"ZINC01479576"	"0.2696419"	"0.7303581"	"Inactive"
"ZINC01486361"	"0.3095762"	"0.6904238"	"Inactive"
"ZINC01489197"	"0.3971287"	"0.6028713"	"Inactive"
"ZINC01489279"	"0.4061837"	"0.5938163"	"Inactive"
"ZINC01489972"	"0.2269010"	"0.7730990"	"Inactive"
"ZINC01508629"	"0.2590895"	"0.7409105"	"Inactive"
"ZINC01534430"	"0.2691620"	"0.7308380"	"Inactive"
"ZINC01536540"	"0.2762402"	"0.7237598"	"Inactive"
"ZINC01538998"	"0.3274135"	"0.6725865"	"Inactive"
"ZINC01539006"	"0.3440036"	"0.6559964"	"Inactive"
"ZINC01540855"	"0.2547445"	"0.7452555"	"Inactive"
"ZINC01540856"	"0.2961449"	"0.7038551"	"Inactive"
"ZINC01548247"	"0.2506022"	"0.7493978"	"Inactive"
"ZINC01550208"	"0.2490640"	"0.7509360"	"Inactive"
"ZINC01552278"	"0.2792121"	"0.7207879"	"Inactive"
"ZINC01552964"	"0.2549500"	"0.7450500"	"Inactive"
"ZINC01554900"	"0.3100489"	"0.6899511"	"Inactive"
"ZINC01583194"	"0.2804287"	"0.7195713"	"Inactive"
"ZINC01646552"	"0.2968260"	"0.7031740"	"Inactive"
"ZINC01669626"	"0.3291606"	"0.6708394"	"Inactive"
"ZINC01742948"	"0.2752097"	"0.7247903"	"Inactive"
"ZINC01772902"	"0.2766531"	"0.7233469"	"Inactive"
"ZINC01773827"	"0.2717309"	"0.7282691"	"Inactive"
"ZINC01785413"	"0.2643566"	"0.7356434"	"Inactive"
"ZINC01785415"	"0.2643566"	"0.7356434"	"Inactive"
"ZINC01822504"	"0.2754830"	"0.7245170"	"Inactive"
"ZINC01837578"	"0.2704950"	"0.7295050"	"Inactive"
"ZINC01871233"	"0.2676610"	"0.7323390"	"Inactive"
"ZINC01936959"	"0.2650896"	"0.7349104"	"Inactive"
"ZINC01976297"	"0.2413718"	"0.7586282"	"Inactive"
"ZINC01976444"	"0.2126006"	"0.7873994"	"Inactive"
"ZINC02007693"	"0.2894202"	"0.7105798"	"Inactive"
"ZINC02008807"	"0.2531878"	"0.7468122"	"Inactive"
"ZINC02011612"	"0.2855240"	"0.7144760"	"Inactive"
"ZINC02049614"	"0.2609098"	"0.7390902"	"Inactive"
"ZINC02056271"	"0.2413108"	"0.7586892"	"Inactive"
"ZINC02057389"	"0.2396803"	"0.7603197"	"Inactive"
"ZINC02057390"	"0.2396803"	"0.7603197"	"Inactive"
"ZINC02085286"	"0.2568552"	"0.7431448"	"Inactive"
"ZINC02089746"	"0.2506570"	"0.7493430"	"Inactive"
"ZINC02096376"	"0.3948672"	"0.6051328"	"Inactive"
"ZINC02123619"	"0.2452872"	"0.7547128"	"Inactive"
"ZINC02175834"	"0.2559324"	"0.7440676"	"Inactive"
"ZINC02185512"	"0.2441813"	"0.7558187"	"Inactive"
"ZINC02206054"	"0.2650715"	"0.7349285"	"Inactive"
"ZINC02212347"	"0.2637025"	"0.7362975"	"Inactive"
"ZINC02223689"	"0.2574250"	"0.7425750"	"Inactive"
"ZINC02235364"	"0.2730208"	"0.7269792"	"Inactive"
"ZINC02246817"	"0.2711915"	"0.7288085"	"Inactive"
"ZINC02261631"	"0.2378866"	"0.7621134"	"Inactive"
"ZINC02299222"	"0.3466191"	"0.6533809"	"Inactive"
"ZINC02317492"	"0.2785998"	"0.7214002"	"Inactive"
"ZINC02321689"	"0.2468707"	"0.7531293"	"Inactive"
"ZINC02339301"	"0.2668633"	"0.7331367"	"Inactive"
"ZINC02341684"	"0.2695550"	"0.7304450"	"Inactive"
"ZINC02341693"	"0.2745786"	"0.7254214"	"Inactive"
"ZINC02393215"	"0.2437844"	"0.7562156"	"Inactive"
"ZINC02420388"	"0.3010843"	"0.6989157"	"Inactive"
"ZINC02440347"	"0.2072634"	"0.7927366"	"Inactive"
"ZINC02443648"	"0.2883903"	"0.7116097"	"Inactive"
"ZINC02445567"	"0.2142533"	"0.7857467"	"Inactive"
"ZINC02478224"	"0.2718526"	"0.7281474"	"Inactive"
"ZINC02480423"	"0.2900959"	"0.7099041"	"Inactive"
"ZINC02484120"	"0.2546498"	"0.7453502"	"Inactive"
"ZINC02484302"	"0.2469393"	"0.7530607"	"Inactive"
"ZINC02484500"	"0.2528492"	"0.7471508"	"Inactive"
"ZINC02487535"	"0.2509944"	"0.7490056"	"Inactive"
"ZINC02487658"	"0.2648527"	"0.7351473"	"Inactive"
"ZINC02500132"	"0.2361243"	"0.7638757"	"Inactive"
"ZINC02531082"	"0.2522203"	"0.7477797"	"Inactive"
"ZINC02590886"	"0.2998194"	"0.7001806"	"Inactive"
"ZINC02590888"	"0.2998194"	"0.7001806"	"Inactive"
"ZINC02621368"	"0.2931651"	"0.7068349"	"Inactive"
"ZINC02621947"	"0.2584058"	"0.7415942"	"Inactive"
"ZINC02627487"	"0.2753718"	"0.7246282"	"Inactive"
"ZINC02629625"	"0.2670713"	"0.7329287"	"Inactive"
"ZINC02632106"	"0.2801521"	"0.7198479"	"Inactive"
"ZINC02633947"	"0.2678601"	"0.7321399"	"Inactive"
"ZINC02639593"	"0.2581904"	"0.7418096"	"Inactive"
"ZINC02642472"	"0.2644225"	"0.7355775"	"Inactive"
"ZINC02652278"	"0.2691611"	"0.7308389"	"Inactive"
"ZINC02653661"	"0.2511899"	"0.7488101"	"Inactive"
"ZINC02654236"	"0.2465181"	"0.7534819"	"Inactive"
"ZINC02685767"	"0.2531918"	"0.7468082"	"Inactive"
"ZINC02687037"	"0.2953557"	"0.7046443"	"Inactive"
"ZINC02696448"	"0.2693281"	"0.7306719"	"Inactive"
"ZINC02705325"	"0.2725911"	"0.7274089"	"Inactive"
"ZINC02707648"	"0.2841142"	"0.7158858"	"Inactive"
"ZINC02721208"	"0.2588133"	"0.7411867"	"Inactive"
"ZINC02744592"	"0.2817975"	"0.7182025"	"Inactive"
"ZINC02744680"	"0.2583874"	"0.7416126"	"Inactive"
"ZINC02759869"	"0.2635484"	"0.7364516"	"Inactive"
"ZINC02836373"	"0.2634867"	"0.7365133"	"Inactive"
"ZINC02843213"	"0.3074039"	"0.6925961"	"Inactive"
"ZINC02851006"	"0.2697354"	"0.7302646"	"Inactive"
"ZINC02856949"	"0.2716397"	"0.7283603"	"Inactive"
"ZINC02860199"	"0.2676159"	"0.7323841"	"Inactive"
"ZINC02880889"	"0.2813136"	"0.7186864"	"Inactive"
"ZINC02881555"	"0.2843482"	"0.7156518"	"Inactive"
"ZINC02907425"	"0.2460994"	"0.7539006"	"Inactive"
"ZINC02911469"	"0.2763233"	"0.7236767"	"Inactive"
"ZINC02922349"	"0.2983389"	"0.7016611"	"Inactive"
"ZINC02952782"	"0.2492899"	"0.7507101"	"Inactive"
"ZINC02971528"	"0.2482919"	"0.7517081"	"Inactive"
"ZINC02976495"	"0.2732245"	"0.7267755"	"Inactive"
"ZINC02976503"	"0.2827214"	"0.7172786"	"Inactive"
"ZINC03025365"	"0.3011685"	"0.6988315"	"Inactive"
"ZINC03028087"	"0.3006996"	"0.6993004"	"Inactive"
"ZINC03028127"	"0.2676058"	"0.7323942"	"Inactive"
"ZINC03058642"	"0.3346910"	"0.6653090"	"Inactive"
"ZINC03065319"	"0.2571203"	"0.7428797"	"Inactive"
"ZINC03084377"	"0.2853748"	"0.7146252"	"Inactive"
"ZINC03143062"	"0.2859890"	"0.7140110"	"Inactive"
"ZINC03187911"	"0.2286844"	"0.7713156"	"Inactive"
"ZINC03201140"	"0.2638049"	"0.7361951"	"Inactive"
"ZINC03213152"	"0.2243543"	"0.7756457"	"Inactive"
"ZINC03213155"	"0.2204349"	"0.7795651"	"Inactive"
"ZINC03214273"	"0.3269126"	"0.6730874"	"Inactive"
"ZINC03214806"	"0.3042903"	"0.6957097"	"Inactive"
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