【Chenomx NMR Suite|核磁共振光谱处理分析软件】正版价格，睿驰科技一级代理

Chenomx NMR Suite结合了复杂的化学和高等算法，可通过宽泛的代谢物光谱模型库识别和量化NMR光谱中的代谢物。

Chenomx NMR分析软件可与综合光谱参考库一起使用，在一个集成的工作流程中识别和测量NMR光谱中可见化合物的浓度。该软件提供浓度测量、识别和光谱去卷积。

Chenomx NMR分析软件光谱参考库是根据通过NMR分析获得的数千个参考光谱开发的，用于识别和比较目的。参考库的pH值范围为4到9，NMR场强范围为400MHz到800MHz。

Chenomx NMR分析软件通过将光谱参考库“拟合”到实验光谱中的适当信号来发挥作用。该软件会自动调整参考库以反映样品和采集条件（pH、NMR场强、谱线宽度），并允许用于调整峰强度和位置以获得微调的浓度值。

拟合实验信号后，频谱的残差线就暴露出来了。分析软件将比较光谱参考库中的更多化合物，以分离和识别剩余的信号。

以下是Chenomx NMR Suite的核心模块：

• Processor

Processor模块可以让您将各种NMR光谱导入Chenomx NMR Suite。它还提供清理和校准这些光谱所需的标准处理工具，以便您可以使用Profiler模块更轻松、准确地分析它们。

• Profiler

Profiler模块可让您通过将混合光谱与具有数百个参考特征的化合物库进行比较来识别和量化混合光谱的内容。

• Library Manager

Library Manager模块让您管理可用于Chenomx NMR Suite中全部其他模块的化合物集。这包括您使用Compound Builder创建的自定义化合物，以及全部标准Chenomx参考化合物。

• Spin Simulator

Spin Simulator模块允许您基于一些理论细节来模拟整个复合签名。只需设置一个磁体频率，然后开始求解耦合关系并测量 j 值常数，同时您的仿真会实时自我更新！

限Professional版

• Compound Builder
  

Compound Builder模块允许您创建自己的自定义化合物签名，并包含定量信息。然后可以在Profiler中分析样本时使用这些签名。

• Batch Import/Batch Process
  

Batch Import/Batch Process将处理步骤应用于样品组。批处理减少了大样本量的处理时间。

• Batch Fit / Batch Edit
  

将单个光谱中的分析化合物应用于整批光谱，以减少分析时间。然后，为标签添加星星、别针和颜色。

• Spectral Binning

Spectral Binning模块通过将光谱划分为一系列ppm区域或bin来减少变量的数量；随后的分析涉及这些箱的综合区域，

而不是原始光谱数据。

Chenomx NMR Suite目前支持以下格式的原始数据：

• Agilent (fid)

• Bruker (fid)

• JEOL (.jdf)

• NMRPipe (.fid)

并以这些格式处理数据：

• Agilent (phasefile)

• Bruker (1r)

• JEOL (.jdf)

• NMRPipe (.ft2)

• JCAMP-DX (.jdx, version 5.1 and higher)

• Mestrelab MNOVA

V9.02版增加了增强的拖放支持、对Apple M1芯片的原生支持以及增强的选项设置。

Processor

• 改进的自动相位

• 从Excel工作薄批量导入样品pH信息

Profiler

• 改进的批量和单个光谱仪的自动浓度拟合包括基于簇的自动浓度拟合

• 导出用于构建置信度指数的统计标准偏差误差

• 大大改进了MetaProfile导入（允许选择特定的化合物）
  

• 改进了光谱区域内的化合物搜索

V9.02的附加功能

• 批量自动浓度拟合和化合物捕捉期间的特定化合物选择

• 从文件面板显示OS浏览器上的文件

• 基于聚类的自动浓度拟合

• 为无需GUI的浓度自动拟合添加新的快捷方式（shift+空格键）

• 双击叠加线以加载相关光谱

应用领域

1. 细胞培养

代谢物分析已被证明是观察和了解培养细胞代谢表型的宝贵工具。在大型生物反应器条件下，存在很多挑战，例如优化生长培养基、生长补料策略和其他工程参数，这些参数不只对细胞生长而且对您的产品生产很关键。借助Chenomx的Profiling技术，获得可靠的定量数据是克服这些挑战的关键。

2. 食物和营养

从必需氨基酸到各种糖类和其他紧要的食物成分（如抗氧化剂），定量测量食物的营养成分是了解食品之间差异的关键。了解与饮食相关的疾病或生长因素，以及它们与食物摄入的相关性对于我们争取更好的健康很关键。早期的营养干预可能会预防未来可能需要帮助的疾病的发作。

3. ***代谢

随着***开发***的飙升，充分了解您的***靶点变得如此关键。代谢组学可以成为***发现的关键工具。从早期毒性检测到细胞水平的作用机制，识别和量化相关生物流体中的代谢物可以弥合对化合物的理解差距。从***开发管道的临床前到临床阶段，额外的定量代谢物数据将为您的***提交增加真正的价值。Chenomx在血清、血浆、尿液、脑脊液、唾液、组织和基于细胞的模型方面拥有多年经验。

4. 生物标志物发现

发现新的生物标志物一直是临床研究人员了解疾病机制并帮助这些疾病的目标。NMR不只提供了一种涵盖各种分子类型的分析方法，而且与 Chenomx技术相结合，随着对样品中成分的鉴定和量化的发现，该技术变得更加有价值。Chenomx拥有多年设计实验、构建诊断模型以及使用临床试验数据验证它们的经验。

系统要求

Chenomx NMR suite可用于：

Windows 10 / 8 / 7 / Vista（64 位）

Mac OS X 10.14 – 10.10（64 位）

Linux x86（64 位）

Chenomx NMR Suite只适用于64位操作系统，因为Java不支持32位体系结构。

【英文介绍】

Chenomx NMR Suite combines sophisticated chemistry and advanced algorithms to identify and quantify metabolites in NMR spectra with an extensive library of spectral models of metabolites.

Used by Metabolomics researchers world-wide, Chenomx NMR Analysis Software works with comprehensive Spectral Reference Libraries to both identify and measure concentrations of compounds visible in the NMR spectra, all in one integrated workflow. This patented software offers best-in-class concentration measurement, identification and advanced de-convolution of spectra.

The Chenomx NMR Analysis SoftwareSpectral Reference Libraries are developed from thousands of reference spectra obtained through NMR analysis and used for identification and comparison purposes. The Reference Libraries are available from pH 4 through 9 and NMR field strengths from 400 MHz through 800 MHz.

Chenomx NMR Analysis Software functions by fitting the Spectral Reference Library to the appropriate signals within the experimental spectrum. The software automatically adjusts the Reference Library to reflect the sample and acquisition conditions (pH, NMR field strength, spectra line width) and allows the used to adjust peak intensity and location for fine-tuned concentration values.

After the experimental signal has been fit, the spectrum&＃39;s residual line is exposed. The profiling software will compare more compounds from the Spectral Reference Library to isolate and identify the remaining signals.

Core Modules

Processor

The Processor module lets you import a wide variety of NMR spectra into Chenomx NMR Suite. It also provides the standard processing tools needed to clean up and calibrate those spectra, so that you can more easily and accurately analyze them using the Profiler module.

Profiler

The Profiler module lets you identify and quantify the contents of your mixture spectrum by comparing it to a compound library with hundreds of reference signatures.

Library Manager

The Library Manager module lets you manage sets of compounds that are available to all other modules in Chenomx NMR Suite. This includes any custom compounds that you&＃39;ve created with Compound Builder, as well as all of the standard Chenomx Reference Compounds.

Spin Simulator

The Spin Simulator module allows you to simulate an entire compound signature based on a few theoretical details. Just set a magnet frequency, then start solving coupling relationships and measuring j-value constants while your simulation updates itself in real time!

Professional Version Only

Compound Builder

The Compound Builder module allows you to create your own custom compound signatures, complete with full quantitative information. These signatures can then be used when analyzing samples in Profiler.

Batch Import / Batch Process

Batch Import/Batch Process applies processing steps to groups of samples. Batching significantly reduces processing time for large sample sizes.

Batch Fit / Batch Edit

Apply profiled compounds from a single spectra to an entire batch of spectra to reduce profiling time. Then, add stars, pins, and colors for labelling.

Spectral Binning

Binning reduces the number of variables by dividing spectra into a series of ppm regions, or bins; subsequent analysis involves the integrated area of these bins

instead of the raw spectral data

Version 9.02 of Chenomx NMR Suite adds enhanced drag and drop support, native support for the Apple M1 Chip, and Enhanced Preference Settings.

Processor

• Improved Automatic Phasing.

• Batch import of Sample pH Information from Excel workbooks.

Profiler

• Improved Automatic Concentration Fitting for both batched and individual spectra includes cluster-based automatic concentration fitting

• Export of statistical Standard Deviation Errors for building Confidence Indices

• Much improved MetaProfile Importing. (allows for selection of specific compounds)

• Improved Compound Searching within Spectral Regions.

Additional Features in V 9.02

• Specific compound selections during batch automated concentration fitting and compound snapping

• Reveal files on the OS Browser from the file panel

• Cluster-based automatic concentration fitting

• Adds a new short-cut for concentration automated fitting without a GUI(shift+space bar)

• Double-clickable overlaid lines to load the associated spectrum