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Your Spreadsheets Can Be FAIR: A Tool and FAIRification Workflow for the eNanoMapper Database.

Nanomaterials (Basel, Switzerland)

Kochev N, Jeliazkova N, Paskaleva V, Tancheva G, Iliev L, Ritchie P, Jeliazkov V.
PMID: 32987901
Nanomaterials (Basel). 2020 Sep 24;10(10). doi: 10.3390/nano10101908.

The field of nanoinformatics is rapidly developing and provides data driven solutions in the area of nanomaterials (NM) safety. Safe by Design approaches are encouraged and promoted through regulatory initiatives and multiple scientific projects. Experimental data is at the...

A bivalent, bispecific Dab-Fc antibody molecule for dual targeting of HER2 and HER3.

mAbs

Rau A, Kocher K, Rommel M, Kühl L, Albrecht M, Gotthard H, Aschmoneit N, Noll B, Olayioye MA, Kontermann RE, Seifert O.
PMID: 33752566
MAbs. 2021 Jan-Dec;13(1):1902034. doi: 10.1080/19420862.2021.1902034.

Dual targeting of surface receptors with bispecific antibodies is attracting increasing interest in cancer therapy. Here, we present a novel bivalent and bispecific antagonistic molecule (Dab-Fc) targeting human epidermal growth factors 2 and 3 (HER2 and HER3) derived from...

Ultrafast Quenching of Excitons in the Zn.

Nanomaterials (Basel, Switzerland)

Cherepanov D, Kostrov A, Gostev F, Shelaev I, Motyakin M, Kochev S, Kabachii Y, Nadtochenko V.
PMID: 34835771
Nanomaterials (Basel). 2021 Nov 09;11(11). doi: 10.3390/nano11113007.

For the first time, a specific time-delayed peak was registered in the femtosecond transient absorption (TA) spectra of Zn

The eNanoMapper database for nanomaterial safety information.

Beilstein journal of nanotechnology

Jeliazkova N, Chomenidis C, Doganis P, Fadeel B, Grafström R, Hardy B, Hastings J, Hegi M, Jeliazkov V, Kochev N, Kohonen P, Munteanu CR, Sarimveis H, Smeets B, Sopasakis P, Tsiliki G, Vorgrimmler D, Willighagen E.
PMID: 26425413
Beilstein J Nanotechnol. 2015 Jul 27;6:1609-34. doi: 10.3762/bjnano.6.165. eCollection 2015.

BACKGROUND: The NanoSafety Cluster, a cluster of projects funded by the European Commision, identified the need for a computational infrastructure for toxicological data management of engineered nanomaterials (ENMs). Ontologies, open standards, and interoperable designs were envisioned to empower a...

Elastic and inelastic alpha scattering on 36Ar at E alpha =40, 48, and 54 MeV.

Physical review. C, Nuclear physics

Abele H, Eversheim PD, Hinterberger F, Hoyler F, Kocher K, Mohr P, Neu R, Staudt G.
PMID: 9967740
Phys Rev C Nucl Phys. 1992 Jan;45(1):123-131. doi: 10.1103/physrevc.45.123.

No abstract available.

Towards FAIR nanosafety data.

Nature nanotechnology

Jeliazkova N, Apostolova MD, Andreoli C, Barone F, Barrick A, Battistelli C, Bossa C, Botea-Petcu A, Châtel A, De Angelis I, Dusinska M, El Yamani N, Gheorghe D, Giusti A, Gómez-Fernández P, Grafström R, Gromelski M, Jacobsen NR, Jeliazkov V, Jensen KA, Kochev N, Kohonen P, Manier N, Mariussen E, Mech A, Navas JM, Paskaleva V, Precupas A, Puzyn T, Rasmussen K, Ritchie P, Llopis IR, Rundén-Pran E, Sandu R, Shandilya N, Tanasescu S, Haase A, Nymark P.
PMID: 34017099
Nat Nanotechnol. 2021 Jun;16(6):644-654. doi: 10.1038/s41565-021-00911-6. Epub 2021 May 20.

Nanotechnology is a key enabling technology with billions of euros in global investment from public funding, which include large collaborative projects that have investigated environmental and health safety aspects of nanomaterials, but the reuse of accumulated data is clearly...

Polyaniline/Platinum Composite Cathode Catalysts Towards Durable Polymer Electrolyte Membrane Fuel Cells.

ChemistryOpen

Kocher K, Hacker V.
PMID: 33194529
ChemistryOpen. 2020 Nov 05;9(11):1109-1112. doi: 10.1002/open.202000119. eCollection 2020 Nov.

Polymer stabilization proved to be a promising approach to increase the catalytic performance of common platinum/carbon based cathode catalysts (Pt/C) used in polymer electrolyte membrane fuel cells (PEMFCs). Platinum and polyaniline composite catalysts (Pt/C/PANI) were prepared by combining chemical...

CADASTER QSPR Models for Predictions of Melting and Boiling Points of Perfluorinated Chemicals.

Molecular informatics

Bhhatarai B, Teetz W, Liu T, Öberg T, Jeliazkova N, Kochev N, Pukalov O, Tetko IV, Kovarich S, Papa E, Gramatica P.
PMID: 27466773
Mol Inform. 2011 Mar 14;30(2):189-204. doi: 10.1002/minf.201000133. Epub 2011 Mar 17.

Quantitative structure property relationship (QSPR) studies on per- and polyfluorinated chemicals (PFCs) on melting point (MP) and boiling point (BP) are presented. The training and prediction chemicals used for developing and validating the models were selected from Syracuse PhysProp...

Towards FAIR nanosafety data.

Nature nanotechnology

Jeliazkova N, Apostolova MD, Andreoli C, Barone F, Barrick A, Battistelli C, Bossa C, Botea-Petcu A, Châtel A, De Angelis I, Dusinska M, El Yamani N, Gheorghe D, Giusti A, Gómez-Fernández P, Grafström R, Gromelski M, Jacobsen NR, Jeliazkov V, Jensen KA, Kochev N, Kohonen P, Manier N, Mariussen E, Mech A, Navas JM, Paskaleva V, Precupas A, Puzyn T, Rasmussen K, Ritchie P, Llopis IR, Rundén-Pran E, Sandu R, Shandilya N, Tanasescu S, Haase A, Nymark P.
PMID: 34017099
Nat Nanotechnol. 2021 Jun;16(6):644-654. doi: 10.1038/s41565-021-00911-6. Epub 2021 May 20.

Nanotechnology is a key enabling technology with billions of euros in global investment from public funding, which include large collaborative projects that have investigated environmental and health safety aspects of nanomaterials, but the reuse of accumulated data is clearly...

Erratum to: ExCAPE-DB: an integrated large scale dataset facilitating Big Data analysis in chemogenomics.

Journal of cheminformatics

Sun J, Jeliazkova N, Chupakhin V, Golib-Dzib JF, Engkvist O, Carlsson L, Wegner J, Ceulemans H, Georgiev I, Jeliazkov V, Kochev N, Ashby TJ, Chen H.
PMID: 29086166
J Cheminform. 2017 Jun 14;9(1):41. doi: 10.1186/s13321-017-0222-2.

No abstract available.

Ambit-SMIRKS: a software module for reaction representation, reaction search and structure transformation.

Journal of cheminformatics

Kochev N, Avramova S, Jeliazkova N.
PMID: 30128804
J Cheminform. 2018 Aug 20;10(1):42. doi: 10.1186/s13321-018-0295-6.

Ambit-SMIRKS is an open source software, enabling structure transformation via the SMIRKS language and implemented as an extension of Ambit-SMARTS. As part of the Ambit project it builds on top of The Chemistry Development Kit (The CDK). Ambit-SMIRKS provides...

ExCAPE-DB: an integrated large scale dataset facilitating Big Data analysis in chemogenomics.

Journal of cheminformatics

Sun J, Jeliazkova N, Chupakin V, Golib-Dzib JF, Engkvist O, Carlsson L, Wegner J, Ceulemans H, Georgiev I, Jeliazkov V, Kochev N, Ashby TJ, Chen H.
PMID: 28316655
J Cheminform. 2017 Mar 07;9:17. doi: 10.1186/s13321-017-0203-5. eCollection 2017.

Chemogenomics data generally refers to the activity data of chemical compounds on an array of protein targets and represents an important source of information for building

Showing 1 to 12 of 60 entries