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1、INVITEDPAPERTakingtheHumanOutoftheLoop:AReviewofBayesianOptimizationThepaperintroducesthereadertoBayesianoptimizationhighlightingitsmethodicalaspectsshowcasingitsapplications.ByBobakShahriariKevinSwerskyZiyuWangRyanP.Ada
2、msNodeFreitasABSTRACT|BigDataapplicationsaretypicallyassociatedwithsystemsinvolvinglargenumbersofusersmassivecomplexsoftwaresystemslargescaleheterogeneouscomputingstagearchitectures.Theconstructionofsuchsystemsinvolvesma
3、nydistributeddesignchoices.Theendproducts(e.g.recommendationsystemsmedicalanalysistoolsrealtimegameenginesspeechrecognizers)thusinvolvemanytunableconfigurationparameters.Theseparametersareoftenspecifiedhardcodedintotheso
4、ftwarebyvariousdevelopersteams.Ifoptimizedjointlytheseparameterscanresultinsignificantimprovements.Bayesianoptimizationisapowerfultoolfthejointoptimizationofdesignchoicesthatisgaininggreatpopularityinrecentyears.Itpromis
5、esgreaterautomationsoastoincreasebothproductqualityhumanproductivity.ThisreviewpaperintroducesBayesianoptimizationhighlightssomeofitsmethodologicalaspectsshowcasesawiderangeofapplications.KEYWDS|Decisionmakingdesignofexp
6、erimentsoptimizationresponsesurfacemethodologystatisticallearningI.INTRODUCTIONDesignproblemsarepervasiveinscientificindustrialendeavours:scientistsdesignexperimentstogaininsightsintophysicalsocialphenomenaengineersdesig
7、nmachinestoexecutetasksmeefficientlypharmaceuticalresearchersdesignnewdrugstofightdiseasecompaniesdesignwebsitestoenhanceuserexperienceincreaseadvertisingrevenuegeologistsdesignexplationstrategiestoharnessnaturalresource
8、senvironmentalistsdesignsenswkstomonitecologicalsystemsdevelopersdesignsoftwaretodrivecomputerselectronicdevices.Allthesedesignproblemsarefraughtwithchoiceschoicesthatareoftencomplexhighdimensionalwithinteractionsthatmak
9、ethemdifficultfindividualstoreasonabout.FexamplemanyganizationsroutinelyusethepopularmixedintegerprogrammingsolverIBMILOGCPLEX1fschedulingplanning.Thissolverhas76freeparameterswhichthedesignersmusttunemanuallyVanoverwhel
10、mingnumbertodealwithbyh.Thissearchspaceistoovastfanyonetoeffectivelynavigate.Megenerallyconsiderteamsinlargecompaniesthatdevelopsoftwarelibrariesfotherteamstouse.Theselibrarieshavehundredsthoussoffreechoicesparameterstha
11、tinteractincomplexways.Infactthelevelofcomplexityisoftensohighthatitbecomesimpossibletofinddomainexpertscapableoftuningtheselibrariestogenerateanewproduct.Asasecondexampleconsidermassiveonlinegamesinvolvingthefollowingth
12、reeparties:contentprovidersuserstheanalyticscompanythatsitsbetweenthem.Theanalyticscompanymustdevelopprocedurestoautomaticallydesigngamevariantsacrossmillionsofuserstheobjectiveistoenhanceuserexperiencemaximizethecontent
13、provider’srevenue.ManureceivedMay12015revisedJuly62015acceptedJuly202015.DateofpublicationDecember102015dateofcurrentversionDecember182015.B.ShahriariiswiththeUniversityofBritishColumbiaVancouverBCV6T1Z4Canada(email:).K.
14、SwerskyiswiththeUniversityofTontoTontoONM5S1A1CanadaalsowithTwitterBostonCambridgeMA02139USA(email:).Z.WangiswithOxfdUniversityOxfdOX12JDU.K.alsowithGoogleDeepmindLondonN1C4AGU.K.(email:ziyu@).R.P.AdamsiswithHarvardUnive
15、rsityCambridgeMA02138USAalsowithTwitterUSA(email:).N.deFreitasiswithOxfdUniversityOxfdOX12JDU.K.withGoogleDeepMindLondonN1C4AGU.K.alsowiththeCanadianInstitutefAdvancedResearchTontoONM5G1Z8Canada(email:nodefreitas@).Digit
16、alObjectIdentifier:10.1109JPROC.2015.24942181softwarecommerceoptimizationcplexoptimizer00189219?2015IEEE.Translationscontentminingarepermittedfacademicresearchonly.Personaluseisalsopermittedbutrepublicationredistribution
17、requiresIEEEpermission.See:www.ieee.gpublications_stardspublicationsrightsindex.htmlfmeinfmation.148ProceedingsoftheIEEE|Vol.104No.1January2016Algithm1:Bayesianoptimization1:fn12...do2:newxn1byoptimizingacquisitionfuncti
18、on?xn1argmaxx?xDn3:queryobjectivefunctiontoobtainyn14:augmentdataDn1fDnxn1yn1g5:updatestatisticalmodel6:endfOneproblemwiththisminimumexpectedriskframewkisthatthetruesequentialriskuptothefullevaluationbudgetistypicallycom
19、putationallyintractable.Thishasledtotheintroductionofmanymyopicheuristicsknownasacquisitionfunctionse.g.Thompsonsampling(TS)probabilityofimprovementexpectedimprovement(EI)upperconfidenceboundsentropysearch(ES).Theseacqui
20、sitionfunctionstradeoffexplationexploitationtheiroptimaarelocatedwheretheuncertaintyinthesurrogatemodelislarge(explation)wherethemodelpredictionishigh(exploitation).Bayesianoptimizationalgithmsthenthenextquerypointbymaxi
21、mizingsuchacquisitionfunctions.Naturallytheseacquisitionfunctionsareoftenevenmemultimodaldifficulttooptimizeintermsofqueryingefficiencythantheiginalblackboxfunctionf.Therefeitiscriticalthattheacquisitionfunctionsbecheapt
22、oevaluateapproximate:cheapinrelationtotheexpenseofevaluatingtheblackboxf.Sinceacquisitionfunctionshaveanalyticalfmsthatareeasytoevaluateatleastapproximateitisusuallymucheasiertooptimizethemthantheiginalobjectivefunction.
23、A.PaperOverviewInthispaperweintroducetheingredientsofBayesianoptimizationindepth.OurpresentationisuniqueinthatweaimtodisentanglethemultiplecomponentsthatdeterminethesuccessofBayesianoptimizationimplementations.Inparticul
24、arwefocusonstatisticalmodelingFig.1.IllustrationoftheBayesianoptimizationprocedureoverthreeiterations.Theplotsshowthemeanconfidenceintervalsestimatedwithaprobabilisticmodeloftheobjectivefunction.Althoughtheobjectivefunct
25、ionisshowninpracticeitisunknown.Theplotsalsoshowtheacquisitionfunctionsinthelowershadedplots.Theacquisitionishighwherethemodelpredictsahighobjective(exploitation)wherethepredictionuncertaintyishigh(explation).Notethatthe
26、areaonthefarleftremainsunsampledaswhileithashighuncertaintyitiscrectlypredictedtoofferlittleimprovementoverthehighestobservation[27].Shahriarietal.:TakingtheHumanOutoftheLoop:AReviewofBayesianOptimization150Proceedingsof
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