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1. 发明授权

US07433787B2 System, method, and computer program product using a database in a computing system to compile and compare metabolomic data obtained from a plurality of samples 有权
标题翻译：使用计算系统中的数据库来编制和比较从多个样本获得的代谢组学数据的系统，方法和计算机程序产品
公开(公告)号：US07433787B2
公开(公告)日：2008-10-07
申请号：US11462838
申请日：2006-08-07
申请人： Thomas Henry Barrett, Jr. , Corey Donald DeHaven , Danny C. Alexander
发明人： Thomas Henry Barrett, Jr. , Corey Donald DeHaven , Danny C. Alexander
IPC分类号： G01N24/00 , G06F19/00
CPC分类号： G06F19/26 , G06F19/18 , G06F19/28
摘要： The present invention generates a visual display of metabolomic data compiled by a database and associated processor. More particularly, the present invention provides a database for automatically receiving a three-dimensional spectrometry data set for a group of samples. The present invention also provides a processor device for manipulating the data sets to produce plots that are directly comparable to a plurality of characteristic plots corresponding to a plurality of selected metabolites. Furthermore, the processor device may generate a visual display indicating the presence of the selected metabolites across the group of samples. Thus, the present invention enables a user to analyze a series of complex data sets in a visual display that may indicate the presence of the selected metabolites across the group of samples. Furthermore, the visual display generated by embodiments of the present invention also expedites the subjective analysis of the spectrometry data sets.
摘要翻译：本发明生成由数据库和相关联的处理器编译的代谢组学数据的视觉显示。更具体地，本发明提供一种用于自动接收一组样本的三维光谱数据集的数据库。本发明还提供了一种用于操纵数据集以产生与对应于多个选择的代谢物的多个特征图直接相比的图的处理器装置。此外，处理器设备可以生成指示所选择的代谢物在整个样本组中的存在的视觉显示。因此，本发明使得用户能够分析视觉显示中的一系列复杂数据集，其可以指示所选择的代谢物在整个样本组中的存在。此外，由本发明的实施例产生的视觉显示也加速了对光谱测定数据集的主观分析。

2. 发明授权

US07949475B2 System and method for analyzing metabolomic data 有权
标题翻译：用于分析代谢组学数据的系统和方法
公开(公告)号：US07949475B2
公开(公告)日：2011-05-24
申请号：US12245862
申请日：2008-10-06
申请人： Thomas Henry Barrett, Jr. , Corey Donald DeHaven , Danny C. Alexander , Sarada Tanikella
发明人： Thomas Henry Barrett, Jr. , Corey Donald DeHaven , Danny C. Alexander , Sarada Tanikella
IPC分类号： G01N31/00
CPC分类号： G06F19/703 , G06F19/12 , G06F19/708
摘要： The present invention generates a visual display of metabolomic data compiled by a database and associated processor. More particularly, the present invention provides a database for automatically receiving a three-dimensional spectrometry data set for a group of samples. The present invention also provides a processor device for manipulating the data sets to produce plots that are directly comparable to a plurality of characteristic plots corresponding to a plurality of selected metabolites. Furthermore, the processor device may generate a visual display indicating the presence of the selected metabolites across the group of samples. Thus, the present invention enables a user to analyze a series of complex data sets in a visual display that may indicate the presence of the selected metabolites across the group of samples. Furthermore, the visual display generated by embodiments of the present invention also expedites the subjective analysis of the spectrometry data sets.
摘要翻译：本发明生成由数据库和相关联的处理器编译的代谢组学数据的视觉显示。更具体地，本发明提供一种用于自动接收一组样本的三维光谱数据集的数据库。本发明还提供了一种用于操纵数据集以产生与对应于多个选择的代谢物的多个特征图直接相比的图的处理器装置。此外，处理器设备可以生成指示所选择的代谢物在整个样本组中的存在的视觉显示。因此，本发明使得用户能够分析视觉显示中的一系列复杂数据集，其可以指示所选择的代谢物在整个样本组中的存在。此外，由本发明的实施例产生的视觉显示也加速了对光谱测定数据集的主观分析。

3. 发明申请

US20120239306A1 APPARATUS AND ASSOCIATED METHOD FOR ANALYZING SMALL MOLECULE COMPONENTS IN A COMPLEX MIXTURE 有权
标题翻译：用于分析复合混合物中的小分子组分的装置和相关方法
公开(公告)号：US20120239306A1
公开(公告)日：2012-09-20
申请号：US13431126
申请日：2012-03-27
申请人： Hongping Dai , Corey Donald DeHaven
发明人： Hongping Dai , Corey Donald DeHaven
IPC分类号： G06F19/00
CPC分类号： G06F19/24 , G06F19/703 , G06F19/707 , G06K9/00496 , G06K9/00523 , H01J49/0036 , H01J49/02 , H01J49/26
摘要： A method, apparatus, and computer-readable storage medium are provided for analyzing data from a component separation/mass spectrometer (CS-MS), wherein an intensity peak is determined, with an area thereof determined using an integration procedure, in each two-dimensional data set. The intensity peak indicates a sample component, and the area thereof indicates a relative quantity of the sample component. An integration procedure determines the area of selected peaks of a first portion of the two-dimensional data sets associated with a first sample component, and is applied to the intensity peaks of a second portion having the areas thereof not determined by that integration procedure, to adjust the relative quantity of the first sample component in the second portion samples relative to the relative quantity of the first sample component in the first portion samples. The re-integration may also involve determining whether a second sample component is indicated by the intensity peak.
摘要翻译：提供了一种方法，装置和计算机可读存储介质，用于分析来自组分分离/质谱仪（CS-MS）的数据，其中确定强度峰值，其区域由积分程序确定，维数据集。强度峰表示样品成分，其面积表示样品成分的相对量。积分过程确定与第一样本分量相关联的二维数据集的第一部分的所选择的峰的面积，并将其应用于具有未被该积分程序确定的区域的第二部分的强度峰值，调整第二部分样品中第一样品组分相对于第一部分样品中第一样品组分的相对量的相对量。重新整合还可以涉及确定第二样本分量是否由强度峰值指示。

4. 发明授权

US08175816B2 System and method for analyzing metabolomic data 有权
标题翻译：用于分析代谢组学数据的系统和方法
公开(公告)号：US08175816B2
公开(公告)日：2012-05-08
申请号：US13084999
申请日：2011-04-12
申请人： Thomas Henry Barrett, Jr. , Corey Donald DeHaven , Danny C. Alexander , Sarada Tanikella
发明人： Thomas Henry Barrett, Jr. , Corey Donald DeHaven , Danny C. Alexander , Sarada Tanikella
IPC分类号： G01N31/00
CPC分类号： G06F19/703 , G06F19/12 , G06F19/708
摘要： The present invention generates a visual display of metabolomic data compiled by a database and associated processor. More particularly, the present invention provides a database for automatically receiving a three-dimensional spectrometry data set for a group of samples. The present invention also provides a processor device for manipulating the data sets to produce plots that are directly comparable to a plurality of characteristic plots corresponding to a plurality of selected metabolites. Furthermore, the processor device may generate a visual display indicating the presence of the selected metabolites across the group of samples. Thus, the present invention enables a user to analyze a series of complex data sets in a visual display that may indicate the presence of the selected metabolites across the group of samples. Furthermore, the visual display generated by embodiments of the present invention also expedites the subjective analysis of the spectrometry data sets.
摘要翻译：本发明生成由数据库和相关联的处理器编译的代谢组学数据的视觉显示。更具体地，本发明提供一种用于自动接收一组样本的三维光谱数据集的数据库。本发明还提供了一种用于操纵数据集以产生与对应于多个选择的代谢物的多个特征图直接相比的图的处理器装置。此外，处理器设备可以生成指示所选择的代谢物在整个样本组中的存在的视觉显示。因此，本发明使得用户能够分析视觉显示中的一系列复杂数据集，其可以指示所选择的代谢物在整个样本组中的存在。此外，由本发明的实施例产生的视觉显示也加速了对光谱测定数据集的主观分析。

5. 发明授权

US09189595B2 Apparatus and associated method for analyzing small molecule components in a complex mixture 有权
标题翻译：用于分析复杂混合物中小分子组分的装置和相关方法
公开(公告)号：US09189595B2
公开(公告)日：2015-11-17
申请号：US13431126
申请日：2012-03-27
申请人： Hongping Dai , Corey Donald DeHaven
发明人： Hongping Dai , Corey Donald DeHaven
IPC分类号： G06F19/00 , G06F19/24 , G06K9/00 , H01J49/00 , H01J49/26 , H01J49/02
CPC分类号： G06F19/24 , G06F19/703 , G06F19/707 , G06K9/00496 , G06K9/00523 , H01J49/0036 , H01J49/02 , H01J49/26
摘要： A method, apparatus, and computer-readable storage medium are provided for analyzing data from a component separation/mass spectrometer (CS-MS), wherein an intensity peak is determined, with an area thereof determined using an integration procedure, in each two-dimensional data set. The intensity peak indicates a sample component, and the area thereof indicates a relative quantity of the sample component. An integration procedure determines the area of selected peaks of a first portion of the two-dimensional data sets associated with a first sample component, and is applied to the intensity peaks of a second portion having the areas thereof not determined by that integration procedure, to adjust the relative quantity of the first sample component in the second portion samples relative to the relative quantity of the first sample component in the first portion samples. The re-integration may also involve determining whether a second sample component is indicated by the intensity peak.
摘要翻译：提供了一种方法，装置和计算机可读存储介质，用于分析来自组分分离/质谱仪（CS-MS）的数据，其中确定强度峰值，其区域由积分程序确定，维数据集。强度峰表示样品成分，其面积表示样品成分的相对量。积分过程确定与第一样本分量相关联的二维数据集的第一部分的所选择的峰的面积，并将其应用于具有未被该积分程序确定的区域的第二部分的强度峰值，调整第二部分样品中第一样品组分相对于第一部分样品中第一样品组分的相对量的相对量。重新整合还可以涉及确定第二样本分量是否由强度峰值指示。

6. 发明申请

US20110307180A1 SYSTEM AND METHOD FOR ANALYZING METABOLOMIC DATA 有权
标题翻译：用于分析代谢数据的系统和方法
公开(公告)号：US20110307180A1
公开(公告)日：2011-12-15
申请号：US13084999
申请日：2011-04-12
申请人： Thomas Henry Barrett, JR. , Corey Donald Dehaven , Danny C. Alexander , Sarada Tanikella
发明人： Thomas Henry Barrett, JR. , Corey Donald Dehaven , Danny C. Alexander , Sarada Tanikella
IPC分类号： G06F19/10 , G06F19/26 , G06F19/12
CPC分类号： G06F19/703 , G06F19/12 , G06F19/708
摘要： The present invention generates a visual display of metabolomic data compiled by a database and associated processor. More particularly, the present invention provides a database for automatically receiving a three-dimensional spectrometry data set for a group of samples. The present invention also provides a processor device for manipulating the data sets to produce plots that are directly comparable to a plurality of characteristic plots corresponding to a plurality of selected metabolites. Furthermore, the processor device may generate a visual display indicating the presence of the selected metabolites across the group of samples. Thus, the present invention enables a user to analyze a series of complex data sets in a visual display that may indicate the presence of the selected metabolites across the group of samples. Furthermore, the visual display generated by embodiments of the present invention also expedites the subjective analysis of the spectrometry data sets.
摘要翻译：本发明生成由数据库和相关联的处理器编译的代谢组学数据的视觉显示。更具体地，本发明提供一种用于自动接收一组样本的三维光谱数据集的数据库。本发明还提供了一种用于操纵数据集以产生与对应于多个选择的代谢物的多个特征图直接相比的图的处理器装置。此外，处理器设备可以生成指示所选择的代谢物在整个样本组中的存在的视觉显示。因此，本发明使得用户能够分析视觉显示中的一系列复杂数据集，其可以指示所选择的代谢物在整个样本组中的存在。此外，由本发明的实施例产生的视觉显示也加速了对光谱测定数据集的主观分析。

7. 发明申请

US20090093971A1 System and Method for Analyzing Metabolomic Data 有权
标题翻译：用于分析代谢组学数据的系统和方法
公开(公告)号：US20090093971A1
公开(公告)日：2009-04-09
申请号：US12245862
申请日：2008-10-06
申请人： Thomas Henry Barrett, JR. , Corey Donald DeHaven , Danny C. Alexander , Sarada Tanikella
发明人： Thomas Henry Barrett, JR. , Corey Donald DeHaven , Danny C. Alexander , Sarada Tanikella
IPC分类号： G06F19/00
CPC分类号： G06F19/703 , G06F19/12 , G06F19/708
摘要： The present invention generates a visual display of metabolomic data compiled by a database and associated processor. More particularly, the present invention provides a database for automatically receiving a three-dimensional spectrometry data set for a group of samples. The present invention also provides a processor device for manipulating the data sets to produce plots that are directly comparable to a plurality of characteristic plots corresponding to a plurality of selected metabolites. Furthermore, the processor device may generate a visual display indicating the presence of the selected metabolites across the group of samples. Thus, the present invention enables a user to analyze a series of complex data sets in a visual display that may indicate the presence of the selected metabolites across the group of samples. Furthermore, the visual display generated by embodiments of the present invention also expedites the subjective analysis of the spectrometry data sets.
摘要翻译：本发明生成由数据库和相关联的处理器编译的代谢组学数据的视觉显示。更具体地，本发明提供一种用于自动接收一组样本的三维光谱数据集的数据库。本发明还提供了一种用于操纵数据集以产生与对应于多个选择的代谢物的多个特征图直接相比的图的处理器装置。此外，处理器设备可以生成指示所选择的代谢物在整个样本组中的存在的视觉显示。因此，本发明使得用户能够分析视觉显示中的一系列复杂数据集，其可以指示所选择的代谢物在整个样本组中的存在。此外，由本发明的实施例产生的视觉显示也加速了对光谱测定数据集的主观分析。

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