Projects funded by the NCN

Information on the principal investigator and host institution

Information of the project and the call

Keywords

Equipment

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Towards in silico risk assessment of engineered nanoparticles

2011/01/M/NZ7/01445

Keywords:

Nano-QSAR nanoparticles nanotechnology risk assessment computational (in silico) methods

Descriptors:

  • NZ7_2: Environment and health risks

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

woj. 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 (Y-m-d): 2011-12-30

Project end date (Y-m-d): 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". (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". (15 000 PLN)

Information in the final report

  • Publication in academic press/journals (8)
  • Book publications / chapters in book publications (3)
  1. The performance of selected semi-empirical and DFT methods in studying C₆₀ fullerene derivatives
    Authors:
    Sikorska C., Puzyn T.
    Academic press:
    Nanotechnology (rok: 2015, tom: 26, strony: 455702-455712), Wydawca: IOP Publishing
    Status:
    Published
    DOI:
    10.1088/0957-4484/26/45/455702 - link to the publication
  2. 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 (rok: 2014, tom: Posted online, strony: Posted online), Wydawca: Informa Healthcare
    Status:
    Published
    DOI:
    10.3109/17435390.2014.930195 - 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 (rok: 2015, tom: 26, strony: 15701-15709(9)), Wydawca: IOPscience
    Status:
    Published
    DOI:
    10.1088/0957-4484/26/1/015701 - link to the publication
  4. Computational models of fullerene C60 interactions with selected proteins
    Authors:
    Witt M., Giełdoń A., Gajewicz A., Puzyn T.
    Academic press:
    Nanotechnology (rok: 2016, ), Wydawca: IOP Publishing
    Status:
    Submitted
    DOI:
    brak - link to the publication
  5. 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 (rok: 2016, tom: 126, strony: 238-244), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.ecoenv.2015.12.033 - 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 (rok: 2015, tom: 27, strony: 2400-2407), Wydawca: ACS Publications
    Status:
    Published
    DOI:
    10.1021/cm504406a - link to the publication
  7. 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 (rok: 2015, tom: 15, strony: 1859 - 1867), Wydawca: Bentham Science
    Status:
    Published
    DOI:
    10.2174/1568026615666150506151826 - link to the publication
  8. Addressing a bottle neck for regulation of nanomaterials: Quantitative read-across (Nano-QRA) algorithm for cases when only limited data is available
    Authors:
    Gajewicz A., Jagiello K., Cronin M.T.D., Leszczynski J., Puzyn T.
    Academic press:
    Small (rok: 2016, ), Wydawca: Wiley Online Library
    Status:
    Submitted
    DOI:
    brak - link to the publication
  1. Toksyczność nanocząstek i sposoby jej wyznaczania
    Authors:
    Gajewicz A., Puzyn T., Oberbek P., Woźniak M.
    Book:
    Świat nanocząstek (rok: 2016, tom: -, strony: 291-329), Wydawca: Wydawnictwo Naukowe PWN
    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 (rok: 2013, tom: 1, strony: 1-194), Wydawca: Rozprawa doktorska będąca wynikiem realizacji grantu
    Status:
    Published
  3. 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 (rok: 2012, tom: 25, strony: 221-257), Wydawca: Royal Society of Chemistry Nanoscience & Nanotechnology
    Status:
    Published

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