OPUS: 最新版本发布

QUANT3 - Multivariate Calibration: QUANT3 is for development of multivariate calibrations and provides a project structure for managing spectral data and creating models. There are interesting features and automated steps which allow a smooth workflow. Besides the established PLS algorithm two new algorithms are available: Support Vector Regression (SVR) and Local Regression (LR) which provide more capabilities for heterogeneous data sets and non-linear data.

Project-Based Design: All models, spectra, and results are stored in a single file, simplifying data management.

Data Handling & Validation

Spectra Loading: Supports bulk import from folder trees from different base paths.

Component-Specific Processing: Components are managed individually with handling of missing reference data.

Dataset Splitting: Uses Kennard-Stone algorithm either by reference values even with automatic handling of missing data, or PCA scores.

• Validation Strategy:
  
  Third Dataset: Enables real-time performance checks during model development.
  
  External Validation Set: Manually assignable, excluded from automated splitting, used for testing new data against existing models.
  
  

QUANT3 - continue

Algorithmic Enhancements: Two new algorithms

Support Vector Regression (SVR): Handles heterogeneous and non-linear data

• Kernel based algorithm capturing non-linearities
• Parameters are handled and optimized by an automated grid search within user-defined limits
• Based on PLS scores and requires PLS modeling before but enables full control of the data beforehand and an outlier detection based on the underlying PLS model

Advantages (SRV)

• Deterministic and suitable for pharma
• Works with similar dataset sizes as PLS 

Local Regression (LR): Handles heterogeneous and non-linear data, dynamic modeling

• Library-Based Modeling: Uses compressed spectra and model-free libraries
• PLS Rank Setting: Global (patented approach) or automated per component

Advantages:

• Easy library updates
• Single model for multiple products

Limitations (LR):

• Needs hundreds of samples and is sensitive to data distribution 
• Not robust for minor components and not for pharma use 

THz Measurement: The new THz measurement function for verTera (THz extension of VERTEX NEO vacuum spectrometers) introduces a modernized interface, now seamlessly integrated as a standard OPUS feature. Users benefit from enhanced control options: for vacuum control a dedicated control page is included within the THz dialog. Additionally, for spectrometers equipped with a sample wheel or sample shuttle, users can conveniently select the sample position via the advanced settings page-streamlining setup and improving measurement flexibility.

Interference Solver: By leveraging measured data that contains interference patterns, the solver can accurately determine either the layer thickness when the refractive index is known, or vice versa. This dual-mode flexibility enables users to extract critical optical parameters with greater precision and efficiency.

Support of new Instrument and OVP-X for TANGO II: OVP-X is responsible for the calibration, testing and qualification of TANGO II spectrometers. As such, it provides a comprehensive, reliable and simple calibration and qualification management for TANGO II configurations and makes the setup of new sampling modules easier than before.

All the features at one glance

• Autonomous Composition Identifier, or A.I.D.
• Product Measurement Workflow
• Trend View
• ONet Client Functionality
• The Tutorial Center

Autonomous Composition Identifier, or A.I.D.

Fast and reliable analysis function for complex mixtures and pure substances. The new Composition-ID function is a completely new designed spectra search tool for mixtures and pure components. It requires no input for the expected number of components, provides a multitude of results in one run and automatically selects the one that fits best.   

Product Measurement Workflow

The product measurement workflow enables fast and efficient measurement and evaluation of various samples. Each product precisely defines the measurement and evaluation process and can include an image to facilitate easy navigation within the workflow. Individual products can also be added directly to the home screen for quick access. The result view consolidates multiple results and visually highlights predefined warning and alarm limits for better clarity and decision-making. 

Trend View

The trend view enables the visualization of various result types obtained from product measurements, including Quant 1, Quant 2, and Quick Compare. Outliers, such as those exceeding warning or alarm limits, are clearly highlighted graphically. Users can select different time ranges for analysis and export results in CSV format.

ONet Client Functionality

OPUS TOUCH can serve as an ONet client for ONet 4.0, enabling centralized setup, administration, and control of a network of FTIR instruments from any remote location worldwide.

• Data Exchange: Products can be received from the ONet server, and spectra and results can be uploaded back to it. This integration ensures streamlined operations, robust data access, and efficient instrument network management.
• Local Accessibility: All data and required files remain available locally, allowing for uninterrupted sample analysis even during network downtime.
• User Management: User rights are managed via ONet, with fine-tuning possible directly on the client.
• Monitoring: ONet receives status updates and PQ/OQ reports from connected clients.

The Tutorial Center

The tutorial center, accessible via a new icon in the upper-right corner of the screen, offers a library of video tutorials covering a wide range of TOUCH functions. Context-specific videos are displayed based on the currently active view, ensuring relevant guidance. All tutorials include both audio and subtitles, providing a user-friendly and accessible learning experience.

All the features at one glance

• Autonomous Composition Identifier, or A.I.D.
• Product Measurement Workflow
• Trend View
• ONet Client Functionality
• The Tutorial Center

Autonomous Composition Identifier, or A.I.D.

Fast and reliable analysis function for complex mixtures and pure substances. The new Composition-ID function is a completely new designed spectra search tool for mixtures and pure components. It requires no input for the expected number of components, provides a multitude of results in one run and automatically selects the one that fits best.   

Product Measurement Workflow

The product measurement workflow enables fast and efficient measurement and evaluation of various samples. Each product precisely defines the measurement and evaluation process and can include an image to facilitate easy navigation within the workflow. Individual products can also be added directly to the home screen for quick access. The result view consolidates multiple results and visually highlights predefined warning and alarm limits for better clarity and decision-making. 

Trend View

The trend view enables the visualization of various result types obtained from product measurements, including Quant 1, Quant 2, and Quick Compare. Outliers, such as those exceeding warning or alarm limits, are clearly highlighted graphically. Users can select different time ranges for analysis and export results in CSV format.

ONet Client Functionality

OPUS TOUCH can serve as an ONet client for ONet 4.0, enabling centralized setup, administration, and control of a network of FTIR instruments from any remote location worldwide.

• Data Exchange: Products can be received from the ONet server, and spectra and results can be uploaded back to it. This integration ensures streamlined operations, robust data access, and efficient instrument network management.
• Local Accessibility: All data and required files remain available locally, allowing for uninterrupted sample analysis even during network downtime.
• User Management: User rights are managed via ONet, with fine-tuning possible directly on the client.
• Monitoring: ONet receives status updates and PQ/OQ reports from connected clients.

The Tutorial Center

The tutorial center, accessible via a new icon in the upper-right corner of the screen, offers a library of video tutorials covering a wide range of TOUCH functions. Context-specific videos are displayed based on the currently active view, ensuring relevant guidance. All tutorials include both audio and subtitles, providing a user-friendly and accessible learning experience.

BRAVO手持式拉曼光谱仪软件的新功能包括：

• BRAVO Web访问
  安全的https接口，以便访问系统信息、许可功能、EAP-TLS证书管理和BRAVO屏幕共享功能。
• BRAVO查看器
  安全的https Web访问可实现BRAVO GUI屏幕共享，以及通过网络浏览器对BRAVO软件进行完全远程控制。
• 设备诊断
  更新了设备诊断功能，以便用户快速方便地访问性能状态信息。
• EAP-TLS WiFi身份验证
  支持EAP-TLS协议（自定义证书）。
• 服务模式
  新的服务模式功能，通过布鲁克服务实现完美维护。
• 可连接NTP时间服务器
  控制系统日期及时间的一种新方法是与NTP时间服务器建立单独连接。
  

新的ONET 3.1功能包括：

• 全新、现代的Web用户界面
• 与ONET客户端进行更快、更高效的通信

• 通过.csv导入轻松分配参考值通过.csv导入轻松分配参考值

新的CMET 3.1功能包括：

• 在线偏差、配方控制（简化批量处理）和CMET即服务。
• 支持发射头Q412系列及其附加的单源模式。
• 具有新界面、登录功能和数据库连接的趋势图。