Format
Sort by
Items per page

Send to

Choose Destination

Best matches for Csányi G[au]:

Platelet-derived HMGB1 is a critical mediator of thrombosis. Vogel S et al. J Clin Invest. (2015)

Author Correction: Thermodynamics of CuPt nanoalloys. Rossi K et al. Sci Rep. (2018)

Thermodynamics of CuPt nanoalloys. Rossi K et al. Sci Rep. (2018)

Search results

Items: 1 to 50 of 94

1.

Loss of GTPase activating protein neurofibromin stimulates paracrine cell communication via macropinocytosis.

Ghoshal P, Singla B, Lin H, Cherian-Shaw M, Tritz R, Padgett CA, Hudson F, Zhang H, Stansfield BK, Csányi G.

Redox Biol. 2019 May 30:101224. doi: 10.1016/j.redox.2019.101224. [Epub ahead of print]

2.

Editorial: Oxidants and Redox Signaling in Inflammation.

Singla B, Holmdahl R, Csanyi G.

Front Immunol. 2019 Mar 26;10:545. doi: 10.3389/fimmu.2019.00545. eCollection 2019. No abstract available.

3.

Arterial Lymphatics in Atherosclerosis: Old Questions, New Insights, and Remaining Challenges.

Csányi G, Singla B.

J Clin Med. 2019 Apr 11;8(4). pii: E495. doi: 10.3390/jcm8040495. Review.

4.

Quantifying Chemical Structure and Machine-Learned Atomic Energies in Amorphous and Liquid Silicon.

Bernstein N, Bhattarai B, Csányi G, Drabold DA, Elliott SR, Deringer VL.

Angew Chem Int Ed Engl. 2019 May 20;58(21):7057-7061. doi: 10.1002/anie.201902625. Epub 2019 Apr 17.

5.

Equation of State of Fluid Methane from First Principles with Machine Learning Potentials.

Veit M, Jain SK, Bonakala S, Rudra I, Hohl D, Csányi G.

J Chem Theory Comput. 2019 Apr 9;15(4):2574-2586. doi: 10.1021/acs.jctc.8b01242. Epub 2019 Mar 12.

PMID:
30794393
6.

Reactivity of Amorphous Carbon Surfaces: Rationalizing the Role of Structural Motifs in Functionalization Using Machine Learning.

Caro MA, Aarva A, Deringer VL, Csányi G, Laurila T.

Chem Mater. 2018 Nov 13;30(21):7446-7455. doi: 10.1021/acs.chemmater.8b03353. Epub 2018 Sep 10.

7.

PKCδ stimulates macropinocytosis via activation of SSH1-cofilin pathway.

Singla B, Lin HP, Ghoshal P, Cherian-Shaw M, Csányi G.

Cell Signal. 2019 Jan;53:111-121. doi: 10.1016/j.cellsig.2018.09.018. Epub 2018 Sep 24.

PMID:
30261270
8.

Preconditioners for the geometry optimisation and saddle point search of molecular systems.

Mones L, Ortner C, Csányi G.

Sci Rep. 2018 Sep 18;8(1):13991. doi: 10.1038/s41598-018-32105-x.

9.

Modeling the Phase-Change Memory Material, Ge2Sb2Te5, with a Machine-Learned Interatomic Potential.

Mocanu FC, Konstantinou K, Lee TH, Bernstein N, Deringer VL, Csányi G, Elliott SR.

J Phys Chem B. 2018 Sep 27;122(38):8998-9006. doi: 10.1021/acs.jpcb.8b06476. Epub 2018 Sep 14.

PMID:
30173522
10.

Sildenafil improves vascular endothelial function in patients with cystic fibrosis.

Rodriguez-Miguelez P, Lee N, Tucker MA, Csányi G, McKie KT, Forseen C, Harris RA.

Am J Physiol Heart Circ Physiol. 2018 Nov 1;315(5):H1486-H1494. doi: 10.1152/ajpheart.00301.2018. Epub 2018 Aug 31.

PMID:
30168731
11.

Author Correction: Thermodynamics of CuPt nanoalloys.

Rossi K, Pártay LB, Csányi G, Baletto F.

Sci Rep. 2018 Aug 7;8(1):11956. doi: 10.1038/s41598-018-29408-4.

12.

Data-driven learning and prediction of inorganic crystal structures.

Deringer VL, Proserpio DM, Csányi G, Pickard CJ.

Faraday Discuss. 2018 Oct 26;211(0):45-59. doi: 10.1039/c8fd00034d.

13.

Nested Transition Path Sampling.

Bolhuis PG, Csányi G.

Phys Rev Lett. 2018 Jun 22;120(25):250601. doi: 10.1103/PhysRevLett.120.250601.

PMID:
29979082
14.

Gaussian approximation potential modeling of lithium intercalation in carbon nanostructures.

Fujikake S, Deringer VL, Lee TH, Krynski M, Elliott SR, Csányi G.

J Chem Phys. 2018 Jun 28;148(24):241714. doi: 10.1063/1.5016317.

PMID:
29960342
15.

Comparison of permutationally invariant polynomials, neural networks, and Gaussian approximation potentials in representing water interactions through many-body expansions.

Nguyen TT, Székely E, Imbalzano G, Behler J, Csányi G, Ceriotti M, Götz AW, Paesani F.

J Chem Phys. 2018 Jun 28;148(24):241725. doi: 10.1063/1.5024577.

PMID:
29960316
16.

Identification of novel macropinocytosis inhibitors using a rational screen of Food and Drug Administration-approved drugs.

Lin HP, Singla B, Ghoshal P, Faulkner JL, Cherian-Shaw M, O'Connor PM, She JX, Belin de Chantemele EJ, Csányi G.

Br J Pharmacol. 2018 Sep;175(18):3640-3655. doi: 10.1111/bph.14429. Epub 2018 Aug 1.

PMID:
29953580
17.

Thermodynamics of CuPt nanoalloys.

Rossi K, Pártay LB, Csányi G, Baletto F.

Sci Rep. 2018 Jun 14;8(1):9150. doi: 10.1038/s41598-018-27308-1. Erratum in: Sci Rep. 2018 Aug 7;8(1):11956.

18.

Magnesium Oxide Nanoparticles: Dielectric Properties, Surface Functionalization and Improvement of Epoxy-Based Composites Insulating Properties.

Hornak J, Trnka P, Kadlec P, Michal O, Mentlík V, Šutta P, Csányi GM, Tamus ZÁ.

Nanomaterials (Basel). 2018 May 30;8(6). pii: E381. doi: 10.3390/nano8060381.

19.

Towards an atomistic understanding of disordered carbon electrode materials.

Deringer VL, Merlet C, Hu Y, Lee TH, Kattirtzi JA, Pecher O, Csányi G, Elliott SR, Grey CP.

Chem Commun (Camb). 2018 Jun 8;54(47):5988-5991. doi: 10.1039/c8cc01388h.

20.

Similarity Between Amorphous and Crystalline Phases: The Case of TiO2.

Mavračić J, Mocanu FC, Deringer VL, Csányi G, Elliott SR.

J Phys Chem Lett. 2018 Jun 7;9(11):2985-2990. doi: 10.1021/acs.jpclett.8b01067. Epub 2018 May 21.

21.

Growth Mechanism and Origin of High sp^{3} Content in Tetrahedral Amorphous Carbon.

Caro MA, Deringer VL, Koskinen J, Laurila T, Csányi G.

Phys Rev Lett. 2018 Apr 20;120(16):166101. doi: 10.1103/PhysRevLett.120.166101.

PMID:
29756912
22.

Data-Driven Learning of Total and Local Energies in Elemental Boron.

Deringer VL, Pickard CJ, Csányi G.

Phys Rev Lett. 2018 Apr 13;120(15):156001. doi: 10.1103/PhysRevLett.120.156001.

PMID:
29756876
23.

Realistic Atomistic Structure of Amorphous Silicon from Machine-Learning-Driven Molecular Dynamics.

Deringer VL, Bernstein N, Bartók AP, Cliffe MJ, Kerber RN, Marbella LE, Grey CP, Elliott SR, Csányi G.

J Phys Chem Lett. 2018 Jun 7;9(11):2879-2885. doi: 10.1021/acs.jpclett.8b00902. Epub 2018 May 17.

24.

PKCδ-Mediated Nox2 Activation Promotes Fluid-Phase Pinocytosis of Antigens by Immature Dendritic Cells.

Singla B, Ghoshal P, Lin H, Wei Q, Dong Z, Csányi G.

Front Immunol. 2018 Mar 26;9:537. doi: 10.3389/fimmu.2018.00537. eCollection 2018.

25.

Symmetry-Adapted Machine Learning for Tensorial Properties of Atomistic Systems.

Grisafi A, Wilkins DM, Csányi G, Ceriotti M.

Phys Rev Lett. 2018 Jan 19;120(3):036002. doi: 10.1103/PhysRevLett.120.036002.

PMID:
29400528
26.

Constant-pressure nested sampling with atomistic dynamics.

Baldock RJN, Bernstein N, Salerno KM, Pártay LB, Csányi G.

Phys Rev E. 2017 Oct;96(4-1):043311. doi: 10.1103/PhysRevE.96.043311. Epub 2017 Oct 30.

PMID:
29347557
27.

Machine learning unifies the modeling of materials and molecules.

Bartók AP, De S, Poelking C, Bernstein N, Kermode JR, Csányi G, Ceriotti M.

Sci Adv. 2017 Dec 13;3(12):e1701816. doi: 10.1126/sciadv.1701816. eCollection 2017 Dec.

28.

Many-Body Coarse-Grained Interactions Using Gaussian Approximation Potentials.

John ST, Csányi G.

J Phys Chem B. 2017 Dec 7;121(48):10934-10949. doi: 10.1021/acs.jpcb.7b09636. Epub 2017 Nov 29.

29.

Polytypism in the ground state structure of the Lennard-Jonesium.

Pártay LB, Ortner C, Bartók AP, Pickard CJ, Csányi G.

Phys Chem Chem Phys. 2017 Jul 26;19(29):19369-19376. doi: 10.1039/c7cp02923c.

PMID:
28707687
30.

Extracting Crystal Chemistry from Amorphous Carbon Structures.

Deringer VL, Csányi G, Proserpio DM.

Chemphyschem. 2017 Apr 19;18(8):873-877. doi: 10.1002/cphc.201700151. Epub 2017 Mar 8.

31.

CD47 and Nox1 Mediate Dynamic Fluid-Phase Macropinocytosis of Native LDL.

Csányi G, Feck DM, Ghoshal P, Singla B, Lin H, Nagarajan S, Meijles DN, Al Ghouleh I, Cantu-Medellin N, Kelley EE, Mateuszuk L, Isenberg JS, Watkins S, Pagano PJ.

Antioxid Redox Signal. 2017 Jun 1;26(16):886-901. doi: 10.1089/ars.2016.6834. Epub 2017 Jan 31.

32.

Exploration, Sampling, And Reconstruction of Free Energy Surfaces with Gaussian Process Regression.

Mones L, Bernstein N, Csányi G.

J Chem Theory Comput. 2016 Oct 11;12(10):5100-5110. Epub 2016 Sep 21.

PMID:
27598684
33.

Nox2-Mediated PI3K and Cofilin Activation Confers Alternate Redox Control of Macrophage Pinocytosis.

Ghoshal P, Singla B, Lin H, Feck DM, Cantu-Medellin N, Kelley EE, Haigh S, Fulton D, Csányi G.

Antioxid Redox Signal. 2017 Jun 1;26(16):902-916. doi: 10.1089/ars.2016.6639. Epub 2016 Sep 13.

34.

Modeling Molecular Interactions in Water: From Pairwise to Many-Body Potential Energy Functions.

Cisneros GA, Wikfeldt KT, Ojamäe L, Lu J, Xu Y, Torabifard H, Bartók AP, Csányi G, Molinero V, Paesani F.

Chem Rev. 2016 Jul 13;116(13):7501-28. doi: 10.1021/acs.chemrev.5b00644. Epub 2016 May 17. Review.

35.

A universal preconditioner for simulating condensed phase materials.

Packwood D, Kermode J, Mones L, Bernstein N, Woolley J, Gould N, Ortner C, Csányi G.

J Chem Phys. 2016 Apr 28;144(16):164109. doi: 10.1063/1.4947024.

PMID:
27131533
36.

Comparing molecules and solids across structural and alchemical space.

De S, Bartók AP, Csányi G, Ceriotti M.

Phys Chem Chem Phys. 2016 May 18;18(20):13754-69. doi: 10.1039/c6cp00415f.

PMID:
27101873
37.

Platelet-derived HMGB1 is a critical mediator of thrombosis.

Vogel S, Bodenstein R, Chen Q, Feil S, Feil R, Rheinlaender J, Schäffer TE, Bohn E, Frick JS, Borst O, Münzer P, Walker B, Markel J, Csanyi G, Pagano PJ, Loughran P, Jessup ME, Watkins SC, Bullock GC, Sperry JL, Zuckerbraun BS, Billiar TR, Lotze MT, Gawaz M, Neal MD.

J Clin Invest. 2015 Dec;125(12):4638-54. doi: 10.1172/JCI81660. Epub 2015 Nov 9.

38.

Nox5 stability and superoxide production is regulated by C-terminal binding of Hsp90 and CO-chaperones.

Chen F, Haigh S, Yu Y, Benson T, Wang Y, Li X, Dou H, Bagi Z, Verin AD, Stepp DW, Csanyi G, Chadli A, Weintraub NL, Smith SM, Fulton DJ.

Free Radic Biol Med. 2015 Dec;89:793-805. doi: 10.1016/j.freeradbiomed.2015.09.019. Epub 2015 Oct 9.

39.

Low Speed Crack Propagation via Kink Formation and Advance on the Silicon (110) Cleavage Plane.

Kermode JR, Gleizer A, Kovel G, Pastewka L, Csányi G, Sherman D, De Vita A.

Phys Rev Lett. 2015 Sep 25;115(13):135501. doi: 10.1103/PhysRevLett.115.135501. Epub 2015 Sep 23.

PMID:
26451566
40.

The adaptive buffered force QM/MM method in the CP2K and AMBER software packages.

Mones L, Jones A, Götz AW, Laino T, Walker RC, Leimkuhler B, Csányi G, Bernstein N.

J Comput Chem. 2015 Apr 5;36(9):633-48. doi: 10.1002/jcc.23839. Epub 2015 Feb 3.

41.

MEF2B-Nox1 signaling is critical for stretch-induced phenotypic modulation of vascular smooth muscle cells.

Rodríguez AI, Csányi G, Ranayhossaini DJ, Feck DM, Blose KJ, Assatourian L, Vorp DA, Pagano PJ.

Arterioscler Thromb Vasc Biol. 2015 Feb;35(2):430-8. doi: 10.1161/ATVBAHA.114.304936. Epub 2014 Dec 30.

42.

Nested sampling for materials: the case of hard spheres.

Pártay LB, Bartók AP, Csányi G.

Phys Rev E Stat Nonlin Soft Matter Phys. 2014 Feb;89(2):022302. Epub 2014 Feb 6.

PMID:
25353467
43.

Free Energy Surface Reconstruction from Umbrella Samples Using Gaussian Process Regression.

Stecher T, Bernstein N, Csányi G.

J Chem Theory Comput. 2014 Sep 9;10(9):4079-97. doi: 10.1021/ct500438v.

PMID:
26588550
44.

Analyzing the errors of DFT approximations for compressed water systems.

Alfè D, Bartók AP, Csányi G, Gillan MJ.

J Chem Phys. 2014 Jul 7;141(1):014104. doi: 10.1063/1.4885440.

PMID:
25005274
45.

Oxidative stress in cardiovascular disease.

Csányi G, Miller FJ Jr.

Int J Mol Sci. 2014 Apr 9;15(4):6002-8. doi: 10.3390/ijms15046002.

46.

Thrombospondin-1 activation of signal-regulatory protein-α stimulates reactive oxygen species production and promotes renal ischemia reperfusion injury.

Yao M, Rogers NM, Csányi G, Rodriguez AI, Ross MA, St Croix C, Knupp H, Novelli EM, Thomson AW, Pagano PJ, Isenberg JS.

J Am Soc Nephrol. 2014 Jun;25(6):1171-86. doi: 10.1681/ASN.2013040433. Epub 2014 Feb 7. Erratum in: J Am Soc Nephrol. 2014 Aug;25(8):1884.

47.

Bridged tetrahydroisoquinolines as selective NADPH oxidase 2 (Nox2) inhibitors.

Cifuentes-Pagano E, Saha J, Csányi G, Ghouleh IA, Sahoo S, Rodríguez A, Wipf P, Pagano PJ, Skoda EM.

Medchemcomm. 2013 Jul;4(7):1085-1092.

48.

Thrombospondin-1 and CD47 regulation of cardiac, pulmonary and vascular responses in health and disease.

Rogers NM, Sharifi-Sanjani M, Csányi G, Pagano PJ, Isenberg JS.

Matrix Biol. 2014 Jul;37:92-101. doi: 10.1016/j.matbio.2014.01.002. Epub 2014 Jan 11. Review.

49.

Reactive Many-Body Expansion for a Protonated Water Cluster.

Pinski P, Csányi G.

J Chem Theory Comput. 2014 Jan 14;10(1):68-75. doi: 10.1021/ct400488x.

PMID:
26579892
50.

First-principles energetics of water clusters and ice: a many-body analysis.

Gillan MJ, Alfè D, Bartók AP, Csányi G.

J Chem Phys. 2013 Dec 28;139(24):244504. doi: 10.1063/1.4852182.

PMID:
24387379

Supplemental Content

Loading ...
Support Center