布鲁克核磁共振培训课件.ppt

1、1PPT课件Everybody!2PPT课件3PPT课件ICON-NMR:Automation 1ICON-NMR:Automation 14PPT课件ICON-NMR:Automation 2ICON-NMR:Automation 25PPT课件First Click Disk Unit ICON-NMR:Automation 2ICON-NMR:Automation 26PPT课件Second Click Dataset name ICON-NMR:Automation 2ICON-NMR:Automation 27PPT课件Third Click Solvent ICON-NMR:Aut

2、omation 2ICON-NMR:Automation 28PPT课件Fourth Click Experiment ICON-NMR:Automation 2ICON-NMR:Automation 29PPT课件Fifth Click Titel ICON-NMR:Automation 2ICON-NMR:Automation 210PPT课件11PPT课件ICON-NMR and user specific wishesICON-NMR and user specific wishesCan I get answers for those many individual user spe

3、cific wishesin ICON-NMR?Yes,withConfiguration12PPT课件User specific wishes?Yes,withConfigurationConfiguration is writable only for nmrsuSome general configurations for quick changesSome user specific configurations for individual setupICON-NMR and user specific wishesICON-NMR and user specific wishes1

4、3PPT课件ICON-NMR:Configuration 1ICON-NMR:Configuration 114PPT课件User Manager:allows user specific configuration of ICON-NMR30 minutes for configurationand spectroscopic life becomes easy and convenient in the future15PPT课件User Permissions:ICON-NMR allows to define a lot useful permission settings just

5、by one mouse click!16PPT课件User requests:ICON-NMR allows to define some lists and specific information!17PPT课件User Names:ICON-NMR offers a list that contains all users who are available for the operating systemand also all Additional users18PPT课件User Names:ICON-NMR offers a list that contains all use

6、rs who are available for the operating systemand also all Additional usersSo each User can get his/her own configuration?Yes,and the list of useful configurations can also be used for users without a login account on the PC 19PPT课件Additional Users:ICON-NMR can create additional userswho do not have

7、a login account on this PC.20PPT课件Additional Users:ICON-NMR can create additional userswho do not have a login account on this PC.I will explain it on an example on the next slide !What is the idea of those additional users?21PPT课件Situation:20 Customers bring there samples to the NMR spectrometer Ac

8、quisition staff has to do the automationProblem:every Customer likes to archive in a individual directory get an email to his/her own email address acquire with special parametersets have an own naming syntax Solution preparation:create for every user an additional user account without password conf

9、igure ICON-NMR for those 20 usersSolution:Acquisition staff just needs to switch the User during automation all settings are automatically correct by one click!22PPT课件Situation:20 Customers bring there samples to the NMR spectrometer Acquisition staff has to do the automationProblem:every Customer l

10、ikes to archive in a individual directory get an email to his/her own email address acquire with special parametersets have an own naming syntax Solution preparation:create for every user an additional user account without password configure ICON-NMR for those 20 usersSolution:Acquisition staff just

11、 needs to switch the User during automation all settings are automatically correct by one click!And why is it useful to work with additional users?Additional users can defined with no or an easy password without security problems for the OS23PPT课件Experiment list:ICON-NMR offers a list that contains

12、all parameter sets who are available forTopSpin24PPT课件Experiment list:ICON-NMR offers a list that contains all parameter sets who are available forTopSpinBut is the parameter set list not too complicated?No,because the list can be modified for every user by deleting/renaming/adding of parameter sets

13、25PPT课件26PPT课件27PPT课件28PPT课件lCustomer Customer lZaphod Beeblebrox,Ford Prefect and Arthur Zaphod Beeblebrox,Ford Prefect and Arthur DentDentl should get an individual ICON-NMR configuration without should get an individual ICON-NMR configuration withoutl having a login account on the operating syste

14、m:having a login account on the operating system:Zaphod Beeblebrox should be able to work with all standard parameter sets.Ford Prefect should be able to work only with Proton and C13CPD.Arthur Dent should be able to work only with Proton and COSY,but needs a somewhat detailed explanation what is th

15、e parameter set for.29PPT课件30PPT课件31PPT课件Data Set Name Edit:Is the user allowed to write in individual dataset namesor is he only allowed to choose from the list32PPT课件Data Set Name Edit:Is the user allowed to write in individual dataset namesor is he only allowed to choose from the listIf the user

16、should only be able to choose from the list?then you make sure,that all datasets get a correct name!33PPT课件Data Set Names:Configurable selection lists for automatically created dataset names(Date,Holder,User)34PPT课件Data Set Names:Configurable selection lists for automatically created dataset names(D

17、ate,Holder,User)So I can define the suggestions for the dataset name?Yes,and if you define only one,you can save one click in automation!35PPT课件Data directories:Configurable selection lists for the dataset path(no network pathes allowed)36PPT课件Data directories:Configurable selection lists for the da

18、taset path(no network pathes allowed)And if I do not need more than one partition?then you save another click during setup of the automation!37PPT课件38PPT课件Priority:allows the user to set the priority flag for his/her experiments.what the priority flag will stand for is defined in the Priority defini

19、tions39PPT课件How to set the flag for priority and day/nightPriority yes/no40PPT课件How to set the flag for priority and day/nightPriority yes/noday/night41PPT课件How to set the flag for priority and day/nightPriority yes/noday/night42PPT课件Priority Settings43PPT课件Aha,so here it is defined what should the

20、two flags stand for!Exactly,the general definition is given here and the user configuration decides if the user can use this or notPriority Settings44PPT课件Wait until current sample is completedorDo Priority Samples immediately Priority Sample Handling:Priority Settings45PPT课件Example for:Do Priority

21、Samples immediately Sample 1 is inside the magnet and five experiments are submitted46PPT课件Example for:Wait until current Sample is completed Sample 1 is inside the magnet and five experiments are submitted First experiment is currently running A second sample with priority is submitted in holder x

22、All five experiments of sample 1 will be acquired BACS changed to holder x Priority experiment is acquired47PPT课件NeverorAll the time(increased changer wear and tear)orOnly at nightUse“First come first served”model:Priority Settings48PPT课件Example for:All the time(increased changer wear andtear)Sample

23、 1 is inside the magnet and acquisition is running A second sample on holder 2 is queued A third sample with priority is placed in Holder 30 the experiment of sample 1 is finished BACS changed to holder 30 Priority experiment is acquired BACS changed back to holder 2123049PPT课件Example for:All the ti

24、me(increased changer wear andtear)Sample 1 is inside the magnet and acquisition is running A second sample on holder 2 is queued A third sample with priority is placed in Holder 30 the experiment of sample 1 is finished BACS changed to holder 30 Priority experiment is acquired BACS changed back to h

25、older 2123050PPT课件Example for:All the time(increased changer wear andtear)Sample 1 is inside the magnet and acquisition is running A second sample on holder 2 is queued A third sample with priority is placed in Holder 30 the experiment of sample 1 is finished BACS changed to holder 30 Priority exper

26、iment is acquired BACS changed back to holder 2123051PPT课件Example for:Never Sample 1 is inside the magnet and acquisition is running A second sample on holder 2 is queued A third sample with priority is placed in Holder 30 the experiment of sample 1 is finished BACS changes to holder 2 the experimen

27、ts of holder 2 are acquired BACS changed to holder 30 priority experiments are acquired123052PPT课件Example for:Never Sample 1 is inside the magnet and acquisition is running A second sample on holder 2 is queued A third sample with priority is placed in Holder 30 the experiment of sample 1 is finishe

28、d BACS changes to holder 2 the experiments of holder 2 are acquired BACS changed to holder 30 priority experiments are acquired123053PPT课件Example for:Never Sample 1 is inside the magnet and acquisition is running A second sample on holder 2 is queued A third sample with priority is placed in Holder

29、30 the experiment of sample 1 is finished BACS changes to holder 2 the experiments of holder 2 are acquired BACS changed to holder 30 priority experiments are acquired123054PPT课件Priority+Night/DayorNight/Day onlyorPriority onlyModes accounted for:Priority Settings55PPT课件So the user can define when t

30、he night starts/stops?Yes,and it is possible to define the duration wherein night experiments can run in idle day timePriority Settings56PPT课件57PPT课件Originator:Configure that the originator fields are visible for the user and that(s)he is able to write information in those fieldsEssential Originator

31、:Define if the user must fill in the originator entries or not58PPT课件Originator:Configure that the originator fields are visible for the user and that(s)he is able to write information in those fieldsEssential Originator:Define if the user must fill in the originator entries or notSo the user is all

32、owed to/has to write in the originator information?Yes,and more details about the idea of this feature are on the next slides!59PPT课件60PPT课件61PPT课件User Specific Originator Info:Individual information for the general Originator Items corresponding to the user necessity62PPT课件User Specific Originator

33、Info:Individual information for the general Originator Items corresponding to the user necessityAha,so every user can use the general originator items and individual information?Exactly,in this way it is very easy to handle a variety of different originator information and user requests!63PPT课件List

34、of all currently defined Originator Items64PPT课件65PPT课件What are the additional topics below the list?Some general settings that are valid for all users!66PPT课件Generate“orig”file in Data Set:67PPT课件Include Originator Item name in orig/title file68PPT课件Insert this text between Originator Items:69PPT课件

35、Display/Document only Originator Items defined for user:Default is a line break70PPT课件The idea of the Originator InformationOriginator Itemsgeneral settingDepartment:Working Group:Responsible Person:Accounting for:Signature:Originator Informationuser specificInorganicDr.XYZDr.whatwashisnameGroup nam

36、e_71PPT课件l(OS)user Hyde has very important and delicate(OS)user Hyde has very important and delicate samplessamplesland should always have specific information on the plot:and should always have specific information on the plot:Define that his sample should be acquired immediately Can define experim

37、ents that should be done at less frequented times He has to has always the following information on the plot:lDepartment:Polyurethane(PU)Department:Polyurethane(PU)lResponsible Person:Dr.JeckyllResponsible Person:Dr.JeckylllSignature:Signature:He likes to store his datasets either on C:BrukerTopSpin

38、 or on E:Hydes_data His datasets names should always contain his name and date of acquisition72PPT课件73PPT课件74PPT课件75PPT课件l(OS)user Spock likes to name his experiments(OS)user Spock likes to name his experimentsautomatically increasing starting at Null815:automatically increasing starting at Null815:

39、Can define experiments that should be done at less frequented times He do not need to have some special information on the plot He should get two different accountings:lOne for his department:KSPSOne for his department:KSPSlOne for himselfOne for himself He likes to store his datasets on E:nterprise

40、76PPT课件77PPT课件78PPT课件79PPT课件80PPT课件Default list of Originator Items contains:Mail Data/Notify toIf an Email address is entered here it will override the setting of the general E-mail address of the user in the User ManagerThis address can be used to send an email execptionally to another recipient e

41、mails should be sent to a general,user specific email address or an experiment specific temporary address81PPT课件Email Notification:the user will get an email notification whether the acquisition was succesful or not82PPT课件Email Notification:the user will get an email notification whether the acquisi

42、tion was succesful or notDataMail:The dataset(JCAMP file)is send as an attachment after processing is finishedTarget Email Address:The general email address that is used if the permissions allows to send an email and if there is not a temporary email address given by the originator item83PPT课件Email

43、Notification:the user will get an email notification whether the acquisition was succesful or notDataMail:The dataset(JCAMP file)is send as an attachment after processing is finishedTarget Email Address:The general email address that is used if the permissions allows to send an email and if there is

44、 not a temporary email address given by the originator itemAcquisition and dataset information sending by email are very important features!Yes,but ICON-NMR offers also the attachment of the print-out as PS or PDF file!84PPT课件85PPT课件Acquisition and Processing86PPT课件87PPT课件88PPT课件Three possibilities

45、of contents and two of addressing?Yes,you can decide,if you want 1,2 or 3 emails and between the 2 ways of addressing!89PPT课件Every email address that is entered once in ICON-NMR is automatically saved and is accessiblefrom within the Mail data/Notify to“originator entryThe information is stored in a

46、 simple text file:confinstrspectinmrusers.mailaddrSyntax:Of course it is possible to add here an already existing list of email addresses90PPT课件91PPT课件92PPT课件93PPT课件Manual Lock/Shim:allows the user to quit the automatic lock and shim procedures and do it manually94PPT课件95PPT课件So some users should be

47、 allowed to lock and shim manually and others not?Yes,in general ICON-NMR should lock and shim,but in some cases it should be in the responsibility of the user!96PPT课件Edit Lock/Shim/ATM:This permission flag allows the user to change the default settings of Lock/Shim/ATM97PPT课件Edit Lock/Shim/ATM:This

48、 permission flag allows the user to change the default settings of Lock/Shim/ATMIf the user has not this permission,(s)he has to accept the default?Yes,and with this permission(s)he can select between different possibilities!98PPT课件99PPT课件l(OS)user Odysseus has his office far away from the(OS)user O

49、dysseus has his office far away from the NMR spectrometer he should be able to decide whether he NMR spectrometer he should be able to decide whether he shims/locks manually or not:shims/locks manually or not:He should always get two different emails to his fix email address heraolymp.gr:-One with t

50、he information about the success of the experiment-One with the plot file He likes to store his datasets on G:reek Manually shimming and locking should be possible100PPT课件101PPT课件102PPT课件JDX Copy:Define whether the user will get a copy of the dataset as JCAMP file corresponding to the general JCAMP