a full-featured chemometrics software online WSC10, 29th February – 4th March 2016, Samara, Russia TPTcloud a full-featured chemometrics software online Andrey Bogomolov1-3, Vladislav Galyanin1, Vadim Belikov1, Valeria Belikova1 1Samara State Technical University, Samara, Russia; 2Global Modelling, Aalen, Germany; 3art photonics GmbH, Berlin, Germany

State-of-the-art & challenges Rapid development of analytical instrumentation (e.g. spectroscopy methods) growing number of analyses and data volumes Growing data complexity stimulates the development of chemometrics new algorithms should be quickly implemented in the software Computational intensity challenge big data, sophisticated algorithms, intensive optimization PC may be insufficient for the modelling Wide dissemination of analysis makes demands for price reduction the analysis steps into the low-selectivity zone specialization: shift from all-purpose analyzers to sensors Increasing communication to the model users modelling, teaching, consulting, model maintenance Need for a new-generation software meeting the requirements and expectations WSC-5, 19 February 2006, Samara

What is TPT? TPT = chemometrics tptcloud.com is an… open… intended for a wide audience multivariate data analysis… chemometrics and machine learning platform… more than just a software …on the web TPT cloud is your data and model home TPT cloud is an open all-in-one chemometrics and data analysis software, social analysis and collaboration tool, safe and reliable cloud storage and computing. TPT cloud is also a chemometrics programming interface for delegating modeling from any client programming environment and language. Two base chemometrics formulas are shown on this slide to clear the terminology which I will use through a presentation. X is for data block, measured spectra, and Y-block is a something we want to predict – moisture, fat, or any other concentrations.

Traditional modelling workflow data model value engineer analyst user device WSC-5, 19 February 2006, Samara

Cloud modelling WSC-5, 19 February 2006, Samara expertise computing storage computing expertise creates a number of new possibilities solves back-up and synchronization problev powerful computing expert resourses WSC-5, 19 February 2006, Samara

Bringing experts and users together. Mission Bringing experts and users together.

TPT-cloud at a glance TPT-cloud is a full-featured chemometrics toolbox for quantitative, qualitative and exploratory data analysis Installation-free platform-independent software works on any PC or mobile device right in your browser Data and model hosting storage, backup, import/export, synchronization on many devices Team work for data analysis share, navigate, data and models Data and model maintenance prediction diagnostics, model training, model transfer, global modelling Power of cloud computing big data analysis, intensive model optimization Application program interface (API) call cloud models and algorithms from your application The main feature of TPT cloud is cloud storage and computing. Its kind of very ambitious idea, but It works. Now your data and models are stored in a unified place, and available for your colleagues by a simple link (but need to note all users must be registered), all tables and pictures you can directly paste to your reports or another software.

Data&model container 3 50 5 1020 Y X T P

Interactivity Process, by definition, is a sequence of changing states and Trajectory can be defined as a line connecting its initial and final states, such as raw material and end product. T. is composed of the sampling points resulting from analysis, and thus having certain errors. T. is discrete but can be fitted by an analytical function to interpolate or extrapolate it beyond the analytical and real-time cursors. T. of a running process should be kept within a predefined acceptability range, and this is one of the main tasks of process control.

Projects and objects Process, by definition, is a sequence of changing states and Trajectory can be defined as a line connecting its initial and final states, such as raw material and end product. T. is composed of the sampling points resulting from analysis, and thus having certain errors. T. is discrete but can be fitted by an analytical function to interpolate or extrapolate it beyond the analytical and real-time cursors. T. of a running process should be kept within a predefined acceptability range, and this is one of the main tasks of process control.

Competition Key features TPT cloud PLS_Toolbox Unscrambler Import/Export of main formats + The main preprocessing methods Linear modeling methods Non-linear modeling - N-way analysis � Multivariate curve resolution DoE tools, calibration design +/- Intensive model optimization Variable/Interval selection Cloud storage/computing Sensor-ready modelling Works under Web browser MATLAB Windows All of our competitors have pros and cons. The main difference of TPT cloud is ability to work online, with collaboration and big teams and to provide intensive model optimization at a dedicated servers on the cloud. You only need google chrome (browser) and register on tptcloud.com to start working.

Development plans Business development strategy: attract new users not only chemometricians! 55 participants at WSC10 chemometrics school Plans 2016: start sales 2017: taking place “among them” by 2020: dominating in the market

Pricing policy Free-of-charge access with limitations e.g. on the number of saved models Time-based licensing flexible one-year license is the main form Single-user one-year license price will be… lower than a competitors‘ desktop software higher than a yearly maintenance Special discount for WSC10 participants one-year license price reduction up to 50% for purchases within 6 months (prior to the release) info@tptcloud.com

Timeline

Visualization and preprocessing

Regression (octane number)

PLS-DA (wines)

Publishing potentials „Camera-ready“ figures highlighted spectra selected intervals Links to the models the whole statistics The best models can be accessed online: Fat content - http://tptcloud.com/model/graph/369 Protein content - http://tptcloud.com/model/graph/370 Process, by definition, is a sequence of changing states and Trajectory can be defined as a line connecting its initial and final states, such as raw material and end product. T. is composed of the sampling points resulting from analysis, and thus having certain errors. T. is discrete but can be fitted by an analytical function to interpolate or extrapolate it beyond the analytical and real-time cursors. T. of a running process should be kept within a predefined acceptability range, and this is one of the main tasks of process control.

Instead of conclusions Go to tptcloud.com, register and try be our beta-tester Let us know, do you like it or not

Acknowledgements For project support The team of developers Prof. Dmitry Bykov, the rector of to Samara State Technical University Dr. Viacheslav Artyushenko (art photonics GmbH) The team of developers Vladislav Galyanin Vadim Belikov Valeria Belikova Eugene Monin Andrey Kirov Nikita Barinov Alex Shreyner All of you for attention!

your data and model home tptcloud.com your data and model home