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1. 发明申请

WO2012141771A1 MICROCHIP AND WEDGE ION FUNNELS AND PLANAR ION BEAM ANALYZERS USING SAME 审中-公开
标题翻译：使用相同的微型和离子束离子束和平面离子束分析仪
公开(公告)号：WO2012141771A1
公开(公告)日：2012-10-18
申请号：PCT/US2012/021338
申请日：2012-01-13
申请人： BATTELLE MEMORIAL INSTITUTE , SHVARTSBURG, Alexandre A. , ANDERSON, Gordon A. , SMITH, Richard D.
发明人： SHVARTSBURG, Alexandre A. , ANDERSON, Gordon A. , SMITH, Richard D.
IPC分类号： H01J49/00 , H01J49/06
CPC分类号： H01J49/0018 , H01J49/066
摘要： Electrodynamic ion funnels confine, guide, or focus ions in gases using the Dehmelt potential of oscillatory electric field. New funnel designs operating at or close to atmospheric gas pressure are described. Effective ion focusing at such pressures is enabled by fields of extreme amplitude and frequency, allowed in microscopic gaps that have much higher electrical breakdown thresholds in any gas than the macroscopic gaps of present funnels. The new microscopic-gap funnels are useful for interfacing atmospheric-pressure ionization sources to mass spectrometry (MS) and ion mobility separation (IMS) stages including differential IMS or FAIMS, as well as IMS and MS stages in various configurations. In particular, "wedge" funnels comprising two planar surfaces positioned at an angle and wedge funnel traps derived therefrom can compress ion beams in one dimension, producing narrow belt-shaped beams and laterally elongated cuboid packets. This beam profile reduces the ion density and thus space-charge effects, mitigating the adverse impact thereof on the resolving power, measurement accuracy, and dynamic range of MS and IMS analyzers, while a greater overlap with coplanar light or particle beams can benefit spectroscopic methods.
摘要翻译：电动离子漏斗使用振荡电场的Dehmelt电位限制，引导或聚焦气体中的离子。描述了处于或接近大气压力的新漏斗设计。在这种压力下的有效离子聚焦是通过极大幅度和频率的场来实现的，微观间隙允许在任何气体中具有比当前漏斗的宏观间隙高得多的电击穿阈值。新的微间隙漏斗可用于将大气压电离源与包括差分IMS或FAIMS的质谱（MS）和离子迁移率分离（IMS）阶段以及各种配置的IMS和MS阶段进行接口。特别地，包括两个平坦的表面定位成角度的楔形漏斗和从其衍生的楔形漏斗捕获器可以在一个维度上压缩离子束，产生窄的带状波束和横向延伸的立方体分组。这种光束轮廓降低了离子密度，从而降低了空间电荷效应，减轻了MS和IMS分析仪的分辨率，测量精度和动态范围的不利影响，而与共面光或粒子束的更大重叠可有利于光谱方法。

2. 发明申请

WO2012050642A2 MICROCHIP CAPILLARY ELECTROPHORESIS ABSENT ELECTROKINETIC INJECTION 审中-公开
标题翻译：微芯片毛细血管电泳缺电动脉注射
公开(公告)号：WO2012050642A2
公开(公告)日：2012-04-19
申请号：PCT/US2011041032
申请日：2011-06-20
申请人： BATTELLE MEMORIAL INSTITUTE , SUN XUEFEI , KELLY RYAN T , TANG KEQI , SMITH RICHARD D
发明人： SUN XUEFEI , KELLY RYAN T , TANG KEQI , SMITH RICHARD D
IPC分类号： G01N27/26 , G01N27/447 , G01N35/10
CPC分类号： G01N27/44743 , G01N27/44791 , G01N30/461
摘要： Microchip capillary electrophoresis (CE) utilizing a sample injector based on a mechanical valve rather than electrokinetic injection can provide improved sample injections, enhanced capabilities, and can eliminate the need for changing the electric field in the separation channel to induce sample injection. In one instance CE electrodes continuously apply an electric field for CE separation along a separation channel. A sample channel is connected to the separation channel at an intersection and has a sample pressure that is greater than that which is present in the separation channel near the intersection. The sample channel does not have electrodes that apply voltages for electrokinetic injection. A sample injector in the sample channel or at the intersection comprises a mechanical valve to control sample injection from the sample channel to the separation channel.
摘要翻译：使用基于机械阀而非电动注射的样品注射器的微芯片毛细管电泳（CE）可以提供改进的样品注射，增强的能力，并且可以消除改变分离通道中的电场以诱导样品注射的需要。在一种情况下，CE电极沿分离通道连续施加用于CE分离的电场。样品通道在交叉点处连接到分离通道，并且样品压力大于在交叉点附近的分离通道中存在的样品压力。样品通道没有为电动注射施加电压的电极。样品通道或相交处的样品注射器包括机械阀以控制样品从样品通道到分离通道的注入。

3. 发明申请

WO2009140390A2 SERUM MARKERS FOR TYPE II DIABETES MELLITUS 审中-公开
标题翻译： II型糖尿病血清标记物
公开(公告)号：WO2009140390A2
公开(公告)日：2009-11-19
申请号：PCT/US2009/043794
申请日：2009-05-13
申请人： BATTELLE MEMORIAL INSTITUTE , METZ, Thomas, O. , QIAN, Wei-Jun , JACOBS, Jon, M. , POLPITIYA, Ashoka, D. , CAMP, David, G. , SMITH, Richard, D.
发明人： METZ, Thomas, O. , QIAN, Wei-Jun , JACOBS, Jon, M. , POLPITIYA, Ashoka, D. , CAMP, David, G. , SMITH, Richard, D.
IPC分类号： G01N33/00
CPC分类号： G01N33/6893 , G01N2800/042
摘要： A method for identifying persons with increased risk of developing type 2 diabetes mellitus, or having type II diabetes mellitus, utilizing selected biomarkers described herein either alone or in combination. The present disclosure allows for broad based, reliable, screening of large population bases and provides other advantages, including the formulation of effective strategies for characterizing, archiving, and contrasting data from multiple sample types under varying conditions. Also provided are arrays and kits that can be used to perform such methods.
摘要翻译：一种利用本文所述的选择的生物标志物单独或组合地鉴定发生2型糖尿病或具有II型糖尿病风险增加的人的方法。本公开允许广泛的，可靠的大量人口基因的筛选，并提供其他优点，包括在不同条件下制定用于表征，归档和对比来自多种样品类型的数据的有效策略。还提供了可用于执行这些方法的数组和工具包。

4. 发明申请

WO2008128029A2 SOLUTION FRAGMENTATION SYSTEMS AND PROCESSES FOR PROTEOMICS ANALYSIS 审中-公开
标题翻译：解决方案的分解系统和过程进行分析
公开(公告)号：WO2008128029A2
公开(公告)日：2008-10-23
申请号：PCT/US2008/060011
申请日：2008-04-11
申请人： BATTELLE MEMORIAL INSTITUTE , PETRITIS, Konstantinos , SMITH, Richard, D.
发明人： PETRITIS, Konstantinos , SMITH, Richard, D.
IPC分类号： G01N33/68
CPC分类号： G01N33/6803 , G01N33/6842
摘要： A solution-phase digestion process is described. Intact proteins are digested to obtain parent peptides, which are separated and subsequently mass analyzed. Individual parent peptides are digested to obtain daughter peptides, which are also subsequently mass analyzed. Accurate mass data obtained from mass analysis of both parent and daughter peptides are correlated with separations data obtained during separation of the parent peptides to provide peptide identification. The process is expected to provide unique peptides by which to identify intact proteins in a sample without need for MS/MS gas-phase fragmentation.
摘要翻译：描述溶液相消解过程。消化完整蛋白质以获得母体肽，其分离并随后进行质量分析。单独的亲本肽被消化以获得子肽，其随后也被质量分析。从母体和子代肽的质量分析获得的准确质量数据与分离亲本肽期间获得的分离数据相关，以提供肽鉴定。该方法预期提供独特的肽，通过其可以鉴定样品中的完整蛋白质，而不需要MS / MS气相片段化。

5. 发明申请

WO2008112351A2 METHOD OF MULTIPLEXED ANALYSIS USING ION MOBILITY SPECTROMETER 审中-公开
标题翻译：使用离子移动光谱仪进行多重分析的方法
公开(公告)号：WO2008112351A2
公开(公告)日：2008-09-18
申请号：PCT/US2008/052565
申请日：2008-01-31
申请人： BATTELLE MEMORIAL INSTITUTE , BELOV, Mikhail, E. , SMITH, Richard, D.
发明人： BELOV, Mikhail, E. , SMITH, Richard, D.
CPC分类号： H01J49/0031 , G01N27/622
摘要： A method for analyzing analytes from a sample introduced into a Spectrometer by generating a pseudo random sequence of a modulation bins, organizing each modulation bin as a series of submodulation bins, thereby forming an extended pseudo random sequence of submodulation bins, releasing the analytes in a series of analyte packets into a Spectrometer, thereby generating an unknown original ion signal vector, detecting the analytes at a detector, and characterizing the sample using the plurality of analyte signal subvectors. The method is advantggeously applied to an Ion Mobility Spectrometer, and an Ion Mobility Spectrometer interfaced with a Time of Flight Mass Spectrometer.
摘要翻译：一种用于通过产生调制箱的伪随机序列来分析从引入到光谱仪中的样品的分析物的方法，将每个调制箱组织成一系列的子调制箱，由此形成扩频的伪随机序列的子调制箱，将分析物在一系列分析物分组进入光谱仪，从而产生未知的原始离子信号矢量，检测检测器处的分析物，并使用多个分析物信号子矢量表征样品。该方法有利于应用于离子迁移光谱仪和离子迁移光谱仪与飞行时间质谱仪接口。

6. 发明申请

WO2006105464A1 METHOD AND APPARATUS FOR ION MOBILITY SPECTROMETRY WITH ALIGNMENT OF DIPOLE DIRECTION (IMS-ADD) 审中-公开
标题翻译：用于离子交换光谱的方法和装置（IMS-ADD）
公开(公告)号：WO2006105464A1
公开(公告)日：2006-10-05
申请号：PCT/US2006/012149
申请日：2006-03-30
申请人： BATTELLE MEMORIAL INSTITUTE , SHVARTSBURG, Alexandre, A. , TANG, Keqi , SMITH, Richard, D.
发明人： SHVARTSBURG, Alexandre, A. , TANG, Keqi , SMITH, Richard, D.
IPC分类号： G01N27/64 , H01J49/40
CPC分类号： G01N27/624 , H01J49/004 , H01J49/40
摘要： Techniques and instrumentation are described for analyses of substances, including complex samples/mixtures that require separation prior to characterization of individual components. A method is disclosed for separation of ion mixtures and identification of ions, including protein and other macromolecular ions and their different structural isomers. Analyte ions are not free to rotate during the separation, but are substantially oriented with respect to the drift direction. Alignment is achieved by applying, at a particular angle to the drift field, a much stronger alternating electric field that "locks" the ion dipoles with moments exceeding a certain value^ That value depends on the buffer gas composition, pressure, and temperature, but may be as low as ~ 3 Debye under certain conditions. The presently disclosed method measures the direction- specific cross-sections that provide the structural information complementing that obtained from known methods, and, when coupled to those methods, increases the total peak capacity and specificity of gas-phase separations. Simultaneous 2-D separations by direction-specific cross sections along and orthogonally to the ion dipole direction are also possible.
摘要翻译：描述了用于分析物质的技术和仪器，包括在表征单个组分之前需要分离的复杂样品/混合物。公开了用于分离离子混合物和鉴定离子的方法，包括蛋白质和其它大分子离子及其不同的结构异构体。分离离子在分离期间不能自由旋转，而是基本上相对于漂移方向取向。通过以特定的角度对漂移场施加更强的交变电场来实现对准，该交变电场以超过一定值的力“锁定”离子偶极子。该值取决于缓冲气体组成，压力和温度，但是在某些条件下可能低至〜3德拜。目前公开的方法测量提供与已知方法获得的结构信息互补的方向特异性横截面，并且当与这些方法耦合时，增加气相分离的总峰容量和特异性。沿垂直于离子偶极方向的方向特定横截面同时进行2-D分离也是可能的。

7. 发明申请

WO2006083262A2 METHOD FOR ENHANCED ACCURACY IN PREDICTING PEPTIDES ELUTION TIME USING LIQUID SEPARATIONS OR CHROMATOGRAPHY 审中-公开
标题翻译：使用液相分离或色谱法预测肽时间的增强精度的方法
公开(公告)号：WO2006083262A2
公开(公告)日：2006-08-10
申请号：PCT/US2005/015604
申请日：2005-05-05
申请人： BATTELLE MEMORIAL INSTITUTE , PETRITIS, Konstantinos , KANGAS, Lars, J. , ANDERSON, Gordon, A. , SMITH, Richard, D.
发明人： PETRITIS, Konstantinos , KANGAS, Lars, J. , ANDERSON, Gordon, A. , SMITH, Richard, D.
IPC分类号： G06F19/00
CPC分类号： C07K1/16 , G01N30/8693 , G01N33/6803 , G01N33/6806 , G01N2030/8831 , G06F19/24
摘要： A method for predicting the elution time of a peptide in chromatographic and electrophoretic separations by first providing a data set of known elution times of known peptides, then creating a plurality of vectors, each vector having a plurality of dimensions, and each dimension representing positional information about at least a portion of the amino acids present in the known peptides. A hypothetical vector is then created by assigning dimensional values for at least one hypothetical peptide, and a predicted elution time for the hypothetical vector is created by performing at least one multivariate regression fitting the hypothetical peptide to the plurality of vectors. Preferably, the multivariate regression is accomplished by the use of an artificial neural network and the elution times are first normalized using linear regression.
摘要翻译：一种用于通过首先提供已知肽的已知洗脱时间的数据集，然后创建多个向量，每个向量具有多个维度，并且每个维度表示位置信息的方法，用于预测肽在色谱和电泳分离中的洗脱时间约至少一部分已知肽中存在的氨基酸。然后通过为至少一个假想肽分配尺寸值来产生假想载体，并且通过对多个载体进行拟合假想肽的至少一个多变量回归而产生假设载体的预测洗脱时间。优选地，通过使用人造神经网络实现多元回归，并且首先使用线性回归归一化洗脱时间。

8. 发明申请

WO2010051051A3 RADIAL ARRAYS OF NANO-ELECTROSPRAY IONIZATION EMITTERS AND METHODS OF FORMING ELECTROSPRAYS 审中-公开
标题翻译：纳米电子放电发射体的辐射阵列及形成电沉积的方法
公开(公告)号：WO2010051051A3
公开(公告)日：2010-09-02
申请号：PCT/US2009035817
申请日：2009-03-03
申请人： BATTELLE MEMORIAL INSTITUTE , KELLY RYAN , TANG KEQI , SMITH RICHARD D
发明人： KELLY RYAN , TANG KEQI , SMITH RICHARD D
IPC分类号： H01J49/16
CPC分类号： H01J49/167
摘要： Electrospray ionization emitter arrays, as well as methods for forming electrosprays, are described. The arrays are characterized by a radial configuration of three or more nano- electrospray ionization emitters without an extractor electrode. The methods are characterized by distributing fluid flow of the liquid sample among three or more nano- electrospray ionization emitters, forming an electrospray at outlets of the emitters without utilizing an extractor electrode, and directing the electrosprays into an entrance to a mass spectrometry device. Each of the nano-electrospray ionization emitters can have a discrete channel for fluid flow. The nano-electrospray ionization emitters are circularly arranged such that each is shielded substantially equally from an electrospray-inducing electric field.
摘要翻译：描述了电喷雾电离发射器阵列，以及用于形成电喷雾的方法。阵列的特征在于没有提取器电极的三个或更多个纳米电喷雾电离发射器的径向构型。所述方法的特征在于在三个或更多个纳米电喷雾电离发射器之间分配液体样品的流体流动，在不使用提取器电极的情况下在发射器的出口处形成电喷雾，并将电喷雾引导到质谱装置的入口。每个纳米电喷雾电离发射器可以具有用于流体流动的离散通道。纳米电喷雾电离发射器是圆形布置的，使得每个发射器基本上等同于电喷雾诱导电场屏蔽。

9. 发明申请

WO2008112351A3 METHOD OF MULTIPLEXED ANALYSIS USING ION MOBILITY SPECTROMETER 审中-公开
标题翻译：使用离子移动光谱仪进行多重分析的方法
公开(公告)号：WO2008112351A3
公开(公告)日：2009-09-24
申请号：PCT/US2008052565
申请日：2008-01-31
申请人： BATTELLE MEMORIAL INSTITUTE , BELOV MIKHAIL E , SMITH RICHARD D
发明人： BELOV MIKHAIL E , SMITH RICHARD D
IPC分类号： H01J49/00
CPC分类号： H01J49/0031 , G01N27/622
摘要： A method for analyzing analytes from a sample introduced into a Spectrometer by generating a pseudo random sequence of a modulation bins, organizing each modulation bin as a series of submodulation bins, thereby forming an extended pseudo random sequence of submodulation bins, releasing the analytes in a series of analyte packets into a Spectrometer, thereby generating an unknown original ion signal vector, detecting the analytes at a detector, and characterizing the sample using the plurality of analyte signal subvectors. The method is advantggeously applied to an Ion Mobility Spectrometer, and an Ion Mobility Spectrometer interfaced with a Time of Flight Mass Spectrometer.
摘要翻译：一种用于通过产生调制箱的伪随机序列来分析从引入到光谱仪中的样品的分析物的方法，将每个调制箱组织成一系列的子调制箱，由此形成扩频的伪随机序列的子调制箱，将分析物在一系列分析物分组进入光谱仪，从而产生未知的原始离子信号矢量，检测检测器处的分析物，并使用多个分析物信号子矢量表征样品。该方法有利于应用于离子迁移光谱仪和离子迁移光谱仪与飞行时间质谱仪接口。

10. 发明申请

WO2004057342A3 METHOD FOR ENHANCED ACCURACY IN PREDICTING THE ELUTION TIMES OF PEPTIDES USING LIQUID SEPARATIONS OR CHROMATOGRAPHY 审中-公开
标题翻译：使用液体分离或色谱法预测肽的时间的增强精度的方法
公开(公告)号：WO2004057342A3
公开(公告)日：2004-10-07
申请号：PCT/US0340949
申请日：2003-12-18
申请人： BATTELLE MEMORIAL INSTITUTE , KANGAS LARS J , AUBERRY KENNETH J , ANDERSON GORDON A , SMITH RICHARD D
发明人： KANGAS LARS J , AUBERRY KENNETH J , ANDERSON GORDON A , SMITH RICHARD D
IPC分类号： G01N33/68 , G06F19/00
CPC分类号： G01N30/8693 , G01N33/6806 , G01N2030/8831 , G06F19/24
摘要： A method for predicting the elution time of a peptide in chromatographic and electrophoretic separations by first providing a data set of known elution times of known peptides, then creating a plurality of vectors, each vector having a plurality of dimensions, and each dimension representing the elution time of amino acids present in each of these known peptides from the data set. The elution time of any protein is then be predicted by first creating a vector by assigning dimensional values for the elution time of amino acids of at least one hypothetical peptide and then calculating a predicted elution time for the vector by performing a multivariate regression of the dimensional values of the hypothetical peptide using the dimensional values of the known peptides. Preferably, the multivariate regression is accomplished by the use of an artificial neural network and the elution times are first normalized using a transfer function.
摘要翻译：一种通过首先提供已知肽的已知洗脱时间的数据集，然后产生多个载体，每个载体具有多个维度，并且每个维度代表洗脱的方法，用于预测肽在色谱和电泳分离中的洗脱时间的方法来自数据集的这些已知肽各自存在的氨基酸的时间。然后通过首先通过分配至少一个假想肽的氨基酸的洗脱时间的维度值来产生载体，然后通过执行尺寸的多元回归来计算载体的预测洗脱时间来预测任何蛋白质的洗脱时间使用已知肽的尺寸值的假想肽的值。优选地，通过使用人造神经网络实现多元回归，并且首先使用传递函数归一化洗脱时间。

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