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The Unscrambler X is a commercial software product for multivariate data analysis, used for calibration of multivariate data which is often in the application of analytical data such as near infrared spectroscopy and Raman spectroscopy, and development of predictive models for use in real-time spectroscopic analysis of materials.
Chemometrics is the science of extracting information from chemical systems by data-driven means. Chemometrics is inherently interdisciplinary, using methods frequently employed in core data-analytic disciplines such as multivariate statistics, applied mathematics, and computer science, in order to address problems in chemistry, biochemistry, medicine, biology and chemical engineering.
2 QuanPol is a full spectrum and seamless (HF, MCSCF, GVB, MP2, DFT, TDDFT, CHARMM, AMBER, OPLSAA) QM/MM package integrated in GAMESS-US. [8] 10 Through CRYSCOR Archived 2019-12-26 at the Wayback Machine program.
Sonata Software Limited is an Indian information technology services company, based in Bangalore. Sonata provides services in business intelligence and analytics , application development management (ADM), mobility , cloud , social media , testing , enterprise services ( ERP and CRM ), and infrastructure management services .
Software by Bruker used with mass spectrometry instruments. DeNovoGUI Open source: The software has a graphical user interface for running parallelized versions of the freely available de novo sequencing software tools Novor and PepNovo+. [51] Easotope Open source: Easotope software archives, organizes, and analyzes mass spectrometer data.
Product One-way Two-way MANOVA GLM Mixed model Post-hoc Latin squares; ADaMSoft: Yes Yes No No No No No Alteryx: Yes Yes Yes Yes Yes Analyse-it: Yes Yes No
This is a list of software used to simulate the material and energy balances of chemical process plants. Applications for this include design studies, engineering studies, design audits, debottlenecking studies, control system check-out, process simulation, dynamic simulation, operator training simulators, pipeline management systems, production management systems, digital twins.
Dundas Data Visualization (formerly Dundas Software) was founded in 1992 in Toronto, Ontario, Canada.. After an early success with Dundas Chart in 2002, the company developed Dundas Gauge, Map, OLAP Chart, and Calendar controls, which were purchased by Microsoft in 2007 to become part of their Reporting Services, SharePoint, and .NET offerings.