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Eco-CosmePharm SIGNED

Computational 'eco-toxicity' assessment of pharmaceutical and cosmetics materials, an approach towards a green and sustainable environment

Total Cost €

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EC-Contrib. €

0

Partnership

0

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 Eco-CosmePharm project word cloud

Explore the words cloud of the Eco-CosmePharm project. It provides you a very rough idea of what is the project "Eco-CosmePharm" about.

chemoinformatics    pharmaceutical    chemicals    balance    trophic    algae    levels    vastly    liquids    toxicophore    ionic    compartments    green    acute    majorly    gained    api    groups    evaluation    ones    mapping    designing    mass    involve    tools    artificial    screening    matched    interspecies    cover    clustering    perform    deep    molecular    knime    intelligence    vertebrates    multimedia    profile    chronic    workflows    organisms    diverse    mm    relationship    plants    invertebrates    structure    fish    understand    daphnids    virtual    qsar    techniques    endpoints    pair    responsible    desirable    data    modeling    search    physicochemical    ai    bioaccumulation    biodegradation    qaar    aquatic    eutectic    environmental    scheming    structural    industries    solvents    utilized    analogues    microorganisms    ingredients    chemical    eco    computational    toxic    software    classifying    quantitative    similarity    environment    active    mmps    toxicity    cosmetic    methodology   

Project "Eco-CosmePharm" data sheet

The following table provides information about the project.

Coordinator
PROTOQSAR 2000 SL 

Organization address
address: C SALVADOR FERRANDIS LUNA 45 PTA 23
city: VALENCIA
postcode: 46018
website: n.a.

contact info
title: n.a.
name: n.a.
surname: n.a.
function: n.a.
email: n.a.
telephone: n.a.
fax: n.a.

 Coordinator Country Spain [ES]
 Total cost 172˙932 €
 EC max contribution 172˙932 € (100%)
 Programme 1. H2020-EU.1.3.2. (Nurturing excellence by means of cross-border and cross-sector mobility)
 Code Call H2020-MSCA-IF-2018
 Funding Scheme MSCA-IF-EF-SE
 Starting year 2019
 Duration (year-month-day) from 2019-07-01   to  2021-06-30

 Partnership

Take a look of project's partnership.

# participants  country  role  EC contrib. [€] 
1    PROTOQSAR 2000 SL ES (VALENCIA) coordinator 172˙932.00

Map

 Project objective

The main goal of the proposed research project is the computational evaluation of eco-toxicity (diverse endpoints) of various chemicals that are vastly utilized and produced by the pharmaceutical and cosmetic industries, such as green solvents (including future ones, i.e., ionic liquids and deep eutectic solvents) and active pharmaceutical ingredients (API). We will be majorly focusing on toxicity in aquatic environment, where the toxicity data will cover four trophic levels of aquatic organisms, i.e., fish (vertebrates), invertebrates such as daphnids, algae (aquatic plants), and microorganisms. The toxicity related properties that will be studied include acute and chronic toxicity, biodegradation and bioaccumulation.

The research methodology to perform toxicity assessment and for understanding the structural features responsible for the eco-toxicity, will involve diverse Artificial Intelligence (AI) and chemoinformatics techniques like Quantitative Structure-Activity Relationship (QSAR), interspecies QSAR (QAAR), toxicophore mapping, virtual screening, similarity search, clustering techniques, multimedia mass-balance (MM) modeling (to understand the distribution profile of chemicals in different environmental compartments), matched molecular pair (MMPs) analysis etc.

The knowledge gained from the study will help in classifying existing chemicals into toxic and non-toxic groups and will also help in designing novel analogues of selected chemical that will show better desirable physicochemical properties with less or no eco-toxicity. This project will also include development of AI software tools and scheming KNIME workflows for various computational tasks.

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The information about "ECO-COSMEPHARM" are provided by the European Opendata Portal: CORDIS opendata.

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