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| 1 | Machine learning property prediction for organic photovoltaic devices显示文摘Organic photovoltaic(OPV)materials are promising candidates for cheap,printable solar cells.However,there are a very large number of potential donors and acceptors,making selection of the best materials difficult.Here,we show that machine-learning approaches can leverage computationally expensive DFT calculations to estimate important OPV materials properties quickly and accurately.We generate quantitative relationships between simple and interpretable chemical signature and one-hot descriptors and OPV power conversion efficiency(PCE),open circuit potential(Voc),short circuit density(Jsc),highest occupied molecular orbital(HOMO)energy,lowest unoccupied molecular orbital(LUMO)energy,and the HOMO–LUMO gap.The most robust and predictive models could predict PCE(computed by DFT)with a standard error of±0.5 for percentage PCE for both the training and test set.This model is useful for pre-screening potential donor and acceptor materials for OPV applications,accelerating design of these devices for green energy applications. | Nastaran Meftahi Mykhailo Klymenko Andrew J.Christofferson Udo Bach David A.Winkler Salvy P.Russo | 2020 | npj Computational Materials2020,,1: | 2 |
| 2 | Pulmonary arteriovenous fistulas显示文摘 | Opanasenko MS Klymenko VI Demus RS et al | 2013 | Klin Khir2013,10,11: | 1 |
| 3 | 显示文摘 | Russell G Evans Oleksiy V Klymenko Christopher Hardacre | 2003 | Journal of Electroanalytical Chemistry2003,556,: | 1 |
| 4 | Monoclonal antibodies directed to CD20 and HLA-DR can elicit homotypic adhesion followed by lysosome-mediated cell death in human lymphoma and leukemia cells显示文摘 | Ivanov Andrei Beers Stephen A Walshe Claire A Honeychurch Jamie Alduaij Waleed Cox Kerry L Potter Kathleen N Murray Stephen Chan Claude H T Klymenko Tetyana Erenpreisa Jekaterina Glennie Martin J Illidge Tim M Cragg Mark S | 2009 | Journal of Clinical Investigation2009,,8: | 1 |
| 5 | A Polycomb group protein complex with sequence-specific DNA-binding andselective methyl- lysine-binding activities显示文摘 | Klymenko T Papp B Fisehle W | 2006 | Genes & Development2006,20,: | 1 |
| 6 | Re- currence of borderline ovarian tumors显示文摘 | Svintsitskiy VS Vorobyova LI Klymenko ES | 2013 | Exp Oncol2013,35,2: | 1 |
| 7 | The novel Bcl-2inhibitor ABT-737 is more effective in hypoxia and is able to reverse hypoxia-induced drug resistance in neuroblasto-ma Cells显示文摘 | Klymenko T Brandenburg M Morrow C | 2011 | Mol Cancer Ther2011,47,10: | 1 |
| 8 | In situ and online monitoring of hydrodynamic flow profiles in microfluidic channels based upon microelectrochemistry:Optimization of electrode locations显示文摘 | Amatore C Klymenko O V Svir I | 2006 | ChemPhysChem2006,7,: | 1 |
| 9 | Kinetic Analysis of the Reaction between Electrogenerated Superoxide and Carbon Dioxide in the Room Temperature Ionic Liquids 1-Ethyl-3-methylimidazolium Bis (trifluoromethylsulfonyl)imide and Hexyltriethylammonium Bis(trifluoromethyl sulfonyl)imide显示文摘 | Klymenko O V Wadhawan J D | 2004 | J Phys Chem2004,108,12: | 1 |
| 10 | Fast scan linear sweep volt ammetry at a high speed wall tube electrode显示文摘 | Rees N V Klymenko O V Coles B A | 2003 | J Electroanaly Chem2003,557,1: | 1 |
| 11 | Protein kinase C in enhanced vascular tone in diabetes mellitus显示文摘 | Kizub IV Klymenko KI Soloviev AI | 2014 | Int J Cardiol2014,174,2: | 1 |
| 12 | Human papillomavirus gene expression is controlled by host cell splicing factors 显示文摘 | KLYMENKO T GRAHAM SV | 2012 | Biochem Soc Trans2012,40,4: | 1 |
| 13 | Blood coagulation factors and platelet response to drug-induced hepatitis and hepatosis in rats显示文摘Background:Knowing the variability of blood coagulation responses to liver damage of different origins can provide a key to curing liver tissues or to mitigating treatment side effects.The aim of the present work was to compare the changes in the main components of hemostasis under experimental drug-induced hepatosis and hepatitis in rats.Methods:We modeled diclofenac-induced hepatitis and tetracycline-induced hepa-tosis.Hemostasis response was gauged by measuring fibrinogen,factor X,protein C(PC),and prothrombin in plasma.The decarboxylated form of prothrombin was de-tected by measuring prothrombin index and ecamulin index.Platelet reactivity was studied using aggregometry.Results:Both hepatitis and hepatosis decreased the synthesis of fibrinogen,factor X,and prothrombin.However,protein carboxylation was not disrupted in hepatosis but was much impaired in hepatitis.PC decreased in both models as a consequence of its consumption possibly during inflammatory response.Platelet aggregation rate was lower in hepatosis but higher in hepatitis.Conclusions:Our findings imply the need for a thorough monitoring of the hemostasis system in liver diseases to avoid possible thrombotic complications.Its state indicates the disorder's rate and character. | Daria Korolova Viktoriya Gryshchenko Tamara Chernyshenko Oleh Platonov Olha Hornytska Volodymyr Chernyshenko Pavlo Klymenko Yevdokiia Reshetnik Tetyana Platonova | 2023 | Animal Models and Experimental Medicine2023,6,1: | 1 |
| 14 | MLL gene alterations in radiation-associated acute myeloid leukemia显示文摘 | Klymenko SV Bink K Trott KR | 2005 | Exp Oncol2005,27,1: | 1 |
| 15 | A Polycomb group protein complex with sequence specific DNA-binding and selective methyl-lysine-binding activities 显示文摘 | Klymenko T Papp B Fischle W | 2006 | Genes Dev2006,20,9: | 1 |
| 16 | The histone methyhransferases Trithorax and Ash1 prevent transcriptional silencing by Polycomb group proteins显示文摘 | KLYMENKO T MULLER J | 2004 | EMBO Rep2004,5,: | 1 |
| 17 | Fast scan linear sweep voltammetry at a high-speed wall-tube electrode显示文摘 | Rees N V Klymenko O V Coles B A | 2003 | J Eleetroanaly Chem2003,557,1: | 1 |
| 18 | The electro-oxidation of N,N-dimethyl-p-toluidine in acetonitrile:a microdisk voltammetry study 显示文摘 | Rees N V Klymenko O V Compton R G | 2002 | Journal of Electroanalytical Chemistry2002,,531: | 1 |
| 19 | Removing of fulvic acids by ozonation and biological active carbon filtration显示文摘 | Klymenko N A Kozyatnyk I P Savchyna L A | 2010 | Water Res2010,44,18: | 1 |
| 20 | Recurrence of borderline ovarian tumors显示文摘 | Svintsitskiy VS Vorobyova LI Klymenko ES | 2013 | Exp Oncol2013,35,2: | 1 |