Towards in silico risk assessment of engineered nanoparticles

2011/01/M/NZ7/01445

Keywords

Descriptors

  • NZ7_2: Zagrożenia środowiskowe

Panel

NZ7 – Diagnostic tools, therapies and public health: public health, epidemiology, environmental health risks and occupational medicine, medical ethics, drug discovery and therapies, pharmacology

Host institution

Uniwersytet Gdański, Wydział Chemii

Voivodeship: pomorskie

Other projects carried out by the institution »

Principal investigator (from the host institution)

dr hab. Tomasz Puzyn

Number of co-investigators in the project: 6

Call

HARMONIA 1 – announced on 2011-03-15

Amount awarded
432 700 PLN
Project start date
2011-12-30
Project end date
2014-12-29
Project duration
36 months (the same as in the proposal)
Project status
Project settled

Equipment purchased [PL]

  1. Stacja robocza z procesorem Intel Xeon W3580 3.33 GHz QPI 6,4 GT/s cache 8MB, płyta Socket LGA1155 ASRock P67 PROFESSIONAL (B3), pamięć DIMM PC-1600 DDR3 12 GB Kingston KHX1600C9D3K3/12GX HyperX Channel, 2x karta graficzna GeForce GT 240 1GB HDMI&DVI CUDA Gigabyte, dysk twardy HDD 2.5" Serial ATA 600 1TB Seagate Constellation 2ST91000640NS cache 64 MB, karta sieciowa INTEL Gigabit Pro/1000GT, nagrywarka CD/DVD R/RW Samsung SE-S084C, obudowa Tracer PROTON TRO-112 400W, klawiatura standard USB, mysz laserowa USB, monitor LCD 27".. Cost: 14 000 PLN
  2. Stacja robocza z procesorem Intel Xeon X5680 3.30 GHz QPI 6,4 GT/s cache 12MB, płyta Socket LGA1366 Asus P6T7 WS SUPERCOMPUTER, pamięć DIMM PC-2000 DDR3 8 GB Kingston KHX2000C9D3T1K2/8GX HyperX, 2x karta graficzna GeForce GTS 450 1GB HDMI&DVI Gigabyte, dysk twardy HDD Solid State Drive 2.5" 300GB SSD 320 Series MLC Serial ATA Intel, karta sieciowa INTEL Gigabit Pro/1000GT, nagrywarka CD/DVD R/RW Samsung SE-S084C, obudowa Tracer PROTON TRO-112 400W, klawiatura standard USB, mysz laserowa USB, monitor LCD 23".. Cost: 15 000 PLN

Information in the final report

Publication in academic press/journals (6)

  1. The performance of selected semi-empirical and DFT methods in studying C₆₀ fullerene derivatives

    Authors:
    Sikorska C., Puzyn T.
    Academic press:
    Nanotechnology (year: 2015, volume: 26, pages: 455702-455712), Publisher: IOP Publishing
    Status:
    Published
    DOI:
    10.1088/0957-4484/26/45/455702 – link to the publication
  2. Extrapolating between toxicity endpoints of metal oxide nanoparticles: Predicting toxicity to Escherichia coli and human keratinocyte cell line (HaCaT) with Nano-QTTR

    Authors:
    Kar S., Gajewicz A., Roy K., Leszczynski J., Puzyn T.
    Academic press:
    Ecotoxicology and Environmental Safety (year: 2016, volume: 126, pages: 238-244), Publisher: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.ecoenv.2015.12.033 – link to the publication
  3. Novel approach for efficient predictions properties of large pool of nanomaterials based on limited set of species: nano-read-across

    Authors:
    Gajewicz A., Cronin M.T.D., Rasulev B., Leszczynski J., Puzyn T.
    Academic press:
    Nanotechnology (year: 2015, volume: 26, pages: 15701-15709(9)), Publisher: IOPscience
    Status:
    Published
    DOI:
    10.1088/0957-4484/26/1/015701 – link to the publication
  4. Towards Understanding Mechanisms Governing Cytotoxicity of Metal Oxides Nanoparticles: Hints from Nano-QSAR Studies

    Authors:
    Gajewicz A., Schaeublin N., Rasulev B., Hussain S., Leszczynska D., Puzyn T., Leszczynski J.
    Academic press:
    Nanotoxicology (year: 2014, volume: Posted online, pages: Posted online), Publisher: Informa Healthcare
    Status:
    Published
    DOI:
    10.3109/17435390.2014.930195 – link to the publication
  5. Ab Initio Studies of Anatase TiO2 (101) Surface-supported Au8 Clusters

    Authors:
    Mikolajczyk A., Pinto H.P., Gajewicz A., Puzyn T., Leszczyński J.
    Academic press:
    Current Topics in Medicinal Chemirstry (year: 2015, volume: 15, pages: 1859 - 1867), Publisher: Bentham Science
    Status:
    Published
    DOI:
    10.2174/1568026615666150506151826 – link to the publication
  6. Zeta Potential for Metal Oxide Nanoparticles: A Predictive Model Developed by a Nano-Quantitative Structure–Property Relationship Approach

    Authors:
    Mikolajczyk A., Gajewicz A., Rasulev B., Schaeublin N., Maurer-Gardner E., Hussain S., Leszczynski J., Puzyn T.
    Academic press:
    Chemistry of Materials (year: 2015, volume: 27, pages: 2400-2407), Publisher: ACS Publications
    Status:
    Published
    DOI:
    10.1021/cm504406a – link to the publication

Book publications / chapters in book publications (3)

  1. Nano-QSAR: Advances and Challenges

    Authors:
    Rasulev B., Gajewicz A., Puzyn T., Leszczynska D., Leszczynski J.
    Book:
    Towards Efficient Designing of Safe Nanomaterials: Innovative Merge of Computational Approaches and Experimental Techniques (year: 2012, volume: 25, pages: 221-257), Publisher: Royal Society of Chemistry Nanoscience & Nanotechnology
    Status:
    Published
  2. Opracowanie metod in silico służących przewidywaniu cytotoksycznego wpływu nanocząstek tlenków nieorganicznych na komórki bakterii E. coli oraz ludzkie keratynocyty (HaCaT)

    Authors:
    Gajewicz A.
    Book:
    Rozprawa doktorska (year: 2013, volume: 1, pages: 1-194), Publisher: Rozprawa doktorska będąca wynikiem realizacji grantu
    Status:
    Published
  3. Toksyczność nanocząstek i sposoby jej wyznaczania

    Authors:
    Gajewicz A., Puzyn T., Oberbek P., Woźniak M.
    Book:
    Świat nanocząstek (year: 2016, volume: -, pages: 291-329), Publisher: Wydawnictwo Naukowe PWN
    Status:
    Published

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Graphic design and implementation: Jakub Piotrowski