Skip to main content
Go to the home page of the European Commission (opens in new window)
English English
CORDIS - EU research results
CORDIS
Content archived on 2024-05-29

Development of Freely Available Predictive Models Based on Simple Chemical Descriptors

Objective

A system of optimal descriptors for modelling by means of quantitative structure property/activity relationships (QSPR/QSAR) biochemical endpoints will be developed. As representation of molecular structure, hydrogen filled graph (HFG), graph of atomic orbitals (GAO), simplified molecular input line entry system (SMILES), and International Chemical Identifier (InChI) will be examined. The GAO is an attempt to take into account atom structure in the QSPR/QSAR analyses. The GAO is an original innovation of the project.

Endocrinal activity, carcinogenic potential, toxic endpoints will be examined as objects of the QSAR analyses with optimal descriptors based on four abovementioned representations of molecular structure. Special software for prediction of these biochemical and biomedicine endpoints will be developed. This software together with detailed instructions will be available for free download at special web site. The developed tools will be very useful for the prediction of properties of chemicals, as requested by the REACH legislative initiative on industrial chemicals.

Fields of science (EuroSciVoc)

CORDIS classifies projects with EuroSciVoc, a multilingual taxonomy of fields of science, through a semi-automatic process based on NLP techniques. See: The European Science Vocabulary.

You need to log in or register to use this function

Topic(s)

Calls for proposals are divided into topics. A topic defines a specific subject or area for which applicants can submit proposals. The description of a topic comprises its specific scope and the expected impact of the funded project.

Call for proposal

Procedure for inviting applicants to submit project proposals, with the aim of receiving EU funding.

FP6-2005-MOBILITY-7
See other projects for this call

Funding Scheme

Funding scheme (or “Type of Action”) inside a programme with common features. It specifies: the scope of what is funded; the reimbursement rate; specific evaluation criteria to qualify for funding; and the use of simplified forms of costs like lump sums.

IIF - Marie Curie actions-Incoming International Fellowships

Coordinator

ISTITUTO DI RICERCHE FARMACOLOGICHE "MARIO NEGRI"
EU contribution
No data
Total cost

The total costs incurred by this organisation to participate in the project, including direct and indirect costs. This amount is a subset of the overall project budget.

No data
My booklet 0 0