ACD/SpecManager
Integration
One of the core purposes of assembling analytical data under one interface is to simplify and speed up the decision-making process. By offering chemists, analysts, and their managers all of the results at a single computer screen or printed report, and linking these results with chemical structural information, ACD/SpecManager greatly facilitates the overall research.
Web Browser Access to the ACD/SpecManager Systems
View and search local and remote ACD/SpecManager databases using a standard Web browser. ACD/Web Librarian allows your scientists to access enterprise structural, spectral, chromatographic, and analytical curve data stored in any ACD/Labs database. Click here for more details.
Spectral Auto-assignment, Interpretation, and Verification in ACD/SpecManager
Many of the processing modules belonging to ACD/SpecManager also feature integration with the spectral predictive modules to offer additional capabilities to accelerate and simplify structure identification and verification. In some cases, these expert systems could be built-in directly with the ACD/SpecManager Processor modules like the Raman and infrared interpretation algorithms or the mass spectrometry auto-assignment of fragments. In other cases, we integrated the advanced capabilities of our industry-standard spectral predictors directly with the Managers.
Click here to find out how the synergistic integration of ACD/1D NMR Manager and ACD/NMR Workbook with ACD/HNMR and/or ACD/CNMR Predictors accelerate structure-spectrum verification and assignment.
Computer-Assisted Structure Elucidation and ACD/SpecManager
Determine the chemical structure of unknowns that are challenging to elucidate from your 13C NMR spectrum or set of 2D NMR spectra and molecular formula, infrared, and mass spectrometry data. ACD/Structure Elucidator is designed as a tool for experts which helps dereplicate and identify unknowns. It combines the capabilities of ACD/NMR Workbook, ACD/UV-IR Manager, and ACD/MS Manager with the ACD/HNMR and CNMR Predictors and three unique algorithms for structure generation. Click here for more details.
Chromatographic Method Development and ACD/SpecManager
ACD/ChromManager integrates with the ACD/LC and GC Simulators to provide the most complete system for chromatographic method development (ACD/Method Development Suite). This system allows databasing, sharing, processing, and optimizing chromatographic applications (HPLC, GC, CE) and for developing new separation methods based on chemical structures and retained chromatographic knowledge. Click here for more details.
Standardize Sample Processing with ACD/Workflow Manager and ACD/SpecManager
Coordinate the sample processing workflow with the management of the ACD/SpecManager analytical database. Click here for more details.
Automated Processing and ACD/SpecManager
Automate analytical processing and databasing across the enterprise to reduce tedious and repetitive tasks with ACD/Automation Server. Click here for more details.
Integration with MDL ISIS Systems
The full NMR, MS, UV-Vis, IR, Raman, and Chromatography processing power of ACD/SpecManager can be accessed through the MDL ISIS/Base interface. You can also link the MDL ISIS/Host remote corporate database with ACD/Labs software. Click here for more details.
Integration with ACD/Labs Nomenclature Software
Incorporate IUPAC names, Index (CAS) names, and InChI labels into databases and reports through integration with ACD/Labs nomenclature products. Read more here.
Integration with ACD/Labs Physicochemical Predictors
Integrate with ACD/Labs molecular property predictors to generate pKa, LogP, LogD, Solubility, and more. Click here for more details about PhysChem products.
Integration Between Waters® NuGenesis* and ACD/SpecManager
ACD/Labs' integration with NuGenesis SDMS allows scientists to use ACD/SpecManager to locate analytical instrumental data in NuGenesis ARCHIVE™. You can restore the original data, process it with ACD/Labs' processing tools, and then re-catalog it with the associated SpecManager metadata tags. Click here for more details.
*Version 6.2 and earlier only
Integration with Instrument Vendor Systems
For more information about technique-specific integration, see the appropriate Web page:
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