NMR flow cell
    24.
    发明授权
    NMR flow cell 有权
    NMR流通池

    公开(公告)号:US09476848B1

    公开(公告)日:2016-10-25

    申请号:US15071331

    申请日:2016-03-16

    Inventor: Martin Hofmann

    CPC classification number: G01N24/08 G01N24/088 G01R33/307 G01R33/31 G01R33/46

    Abstract: Monitoring cell (100) for performing an NMR measurement of a reaction fluid. The monitoring cell (100) has a hollow NMR sample probe (110) for receiving the reaction fluid. Inlet and outlet transport capillaries (112, 123) transport the reaction fluid to and from the sample probe (110). A feed line (306) and return line transport a temperature control fluid to and from the monitoring cell (100). An adapter head (108) couples the transport capillaries (112, 123) to the sample probe (110) and removably connects the sample probe (110) to an adapter section (106). The transport capillaries (112, 123) are positioned within the feed line (306) in parallel to one another. The feed and the return lines (306, 358) are attached to the adapter section (106) such that a reversal of the temperature control fluid stream occurs in the adapter section (106).

    Abstract translation: 监测细胞(100),进行反应液的NMR测定。 监测电池(100)具有用于接收反应流体的中空NMR试样探针(110)。 入口和出口运输毛细管(112,123)将反应流体运送到样品探针(110)和从样品探针(110)传送。 馈送线(306)和返回线将温度控制流体传送到监测电池(100)和从监测电池(100)传送温度控制流体。 适配器头(108)将传送毛细管(112,123)耦合到样品探针(110)并将样品探针(110)可移除地连接到适配器部分(106)。 运输毛细管(112,123)彼此平行地定位在进料管线(306)内。 馈送和返回线(306,358)连接到适配器部分(106),使得温度控制流体流的逆转发生在适配器部分(106)中。

    METHODS OF PREDICTING OF CHEMICAL PROPERTIES FROM SPECTROSCOPIC DATA
    25.
    发明申请
    METHODS OF PREDICTING OF CHEMICAL PROPERTIES FROM SPECTROSCOPIC DATA 审中-公开
    从光谱数据预测化学性质的方法

    公开(公告)号:US20160131603A1

    公开(公告)日:2016-05-12

    申请号:US14898066

    申请日:2014-06-17

    CPC classification number: G01N24/08 G01R33/445 G01R33/46 G01R33/485

    Abstract: A method of predicting of chemical properties from spectroscopic data is described. The chemical property can be, for example, octanol-water partition coefficient (logP), skin permeability (log K,), or other biologically or ecologically relevant property, such as oral bioavailability, skin sensitization, acute aquatic toxicity, chronic aquatic toxicity, aquatic bioaccumulation, or mutagenicity. The spectroscopic data can be experimental or predicted NMR data, e.g., experimental or predicted 1H-NMR or 13C-NMR data.

    Abstract translation: 描述了从光谱数据预测化学性质的方法。 化学性质可以是例如辛醇 - 水分配系数(logP),皮肤渗透性(log K))或其他生物或生态相关性质,例如口服生物利用度,皮肤致敏,急性水生毒性,慢性水生毒性, 水生生物蓄积或致突变性。 光谱数据可以是实验或预测的NMR数据,例如实验或预测的1H-NMR或13C-NMR数据。

    Single-Transient Phase Cycling During Spin Echo Acquisition
    26.
    发明申请
    Single-Transient Phase Cycling During Spin Echo Acquisition 审中-公开
    自旋回波采集期间的单瞬态循环

    公开(公告)号:US20160054412A1

    公开(公告)日:2016-02-25

    申请号:US14780348

    申请日:2013-12-13

    Abstract: An example pulse sequence for performing phase coherence order selection within a single transient acquisition includes an excitation pulse with a tip angle of 90° and phase φA, followed by a train of N refocusing pulses with tip angles of 180°, with the center of the first refocusing pulse occurring time τ after the center of the excitation pulse, and the center of the nth refocusing pulse occurring at time (2n+1)τ after the center of the excitation pulse. This causes a train of echoes to form at times 2nt after the center of the excitation pulse. In this example, the first refocusing pulse has phase φB, where \φB−φA\=90°, and each successive refocusing pulse (304) has a phase φδ greater than the last refocusing pulse. This incremental change in pulse phase over the course of the echo train has the effect of aiabatically “dragging” the echo phase around the unit circle in a predictable manner corresponding to the phase coherence order of the relevant signals.

    Abstract translation: 用于在单个瞬态采集内执行相位相干顺序选择的示例脉冲序列包括尖角为90°的激发脉冲和相位θ,随后是具有尖端角度为180°的N个重新聚焦脉冲串,其中心 在激励脉冲的中心之后的第一重聚焦脉冲发生时间τ和在激发脉冲的中心之后的时间(2n + 1)τ出现的第n个重聚焦脉冲的中心。 这导致在激励脉冲的中心之后的时间2nt处形成一串回波。 在该示例中,第一重聚焦脉冲具有相位B,其中,& B&phgr; A \ = 90°,并且每个连续重聚焦脉冲(304)具有大于最后重聚焦脉冲的相位。 在回波序列过程中脉冲相位的增量变化具有以相应于相关信号的相位相干次序的可预测方式,以单位圆为单位“拖动”回波相位的效果。

    METHOD AND APPARATUS TO DETERMINE COMPLEX SENSITIVITY FACTORS OF RF RECEPTION COILS FOR MAGNETIC RESONANCE SPECTROSCOPY
    28.
    发明申请
    METHOD AND APPARATUS TO DETERMINE COMPLEX SENSITIVITY FACTORS OF RF RECEPTION COILS FOR MAGNETIC RESONANCE SPECTROSCOPY 审中-公开
    用于确定用于磁共振光谱的RF接收线圈的复杂灵敏度因子的方法和装置

    公开(公告)号:US20150331077A1

    公开(公告)日:2015-11-19

    申请号:US14713397

    申请日:2015-05-15

    Inventor: Radhouene Neji

    Abstract: In a method for determining a complex sensitivity factor of an RF reception coil, which is part of an arrangement of a number of RF reception coils of a magnetic resonance scanner, which are operates to simultaneously acquire magnetic resonance spectroscopy data, FID signals from a volume of interest are acquired simultaneously with each of the RF reception coils, and one of the RF reception coils is designated as a reference coil and its FID signal is designated as a reference signal. A complex sensitivity factor for each other RF reception coil is determined by minimizing the differences between a number of data points of its FID signal, weighted with the complex sensitivity factor, and the corresponding data points of the FID signal of the reference coil.

    Abstract translation: 在用于确定RF接收线圈的复杂灵敏度因素的方法中,所述R​​F接收线圈是用于同时获取磁共振波谱数据的磁共振扫描器的多个RF接收线圈的布置的一部分的一种方法,来自体积的FID信号 与每个RF接收线圈同时获取感兴趣的信号,并且将RF接收线圈中的一个指定为参考线圈,并将其FID信号指定为参考信号。 通过最小化其FID信号的数量的数据点与复数灵敏度因子加权的参考线圈的FID信号的相应数据点之间的差异来确定每个其它RF接收线圈的复杂灵敏度因子。

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