TeleSpec

IR Database and IR Spectra Simulation on the WorldWideWeb


The aim of the project TeleSpec is to establish a database of infrared spectra on the WorldWideWeb. This endeavor should demonstrate that scientists can collaborate in providing high-quality information for the benefit of the entire scientific community. In order to encourage collaboration, we provide a tool for the simulation of infrared spectra, also of those that are not available in any database. Using the benefits of the Internet and of modern methods in computational chemistry, the TeleSpec project is based on the use of artificial neural networks and new molecular representations of structures.


Deutsches Forschungsnetz

TeleSpec has been developed at the Computer-Chemie-Centrum of the University of Erlangen-Nürnberg in cooperation with the Technical University of Dresden. The project has been established by the German Research Network (DFN) with the financial support of the German Ministry of Education and Research (bmbf) and with help of Chemical Concepts, the National Cancer Institute, Novartis Pharma, and SGI Germany.

Bundexministerium für Bildung und Forschung
Technische Universität Dresden
Chemical Concepts
National Cancer Institute National Institutes of Health Novartis Pharma
SGI Deutschland