검색결과 : 14건
| No. | Article |
|---|---|
| 1 |
Origins of structural and electronic transitions in disordered silicon Deringer VL, Bernstein N, Csanyi G, Ben Mahmoud C, Ceriotti M, Wilson M, Drabold DA, Elliott SR Nature, 589(7840), 59, 2021 |
| 2 |
Performance and Cost Assessment of Machine Learning Interatomic Potentials Zuo YX, Chen C, Li XG, Deng Z, Chen YM, Behler J, Csanyi G, Shapeev AV, Thompson AP, Wood MA, Ong SP Journal of Physical Chemistry A, 124(4), 731, 2020 |
| 3 |
Modeling the Phase-Change Memory Material, Ge2Sb2Te5, with a Machine-Learned Interatomic Potential Mocanu FC, Konstantinou K, Lee TH, Bernstein N, Deringer VL, Csanyi G, Elliott SR Journal of Physical Chemistry B, 122(38), 8998, 2018 |
| 4 |
Many-Body Coarse-Grained Interactions Using Gaussian Approximation Potentials John ST, Csanyi G Journal of Physical Chemistry B, 121(48), 10934, 2017 |
| 5 |
Modeling Molecular Interactions in Water: From Pairwise to Many Body Potential Energy Functions Cisneros GA, Wikfeldt KT, Ojamae L, Lu JB, Xu Y, Torabifard H, Bartok AP, Csanyi G, Molinero V, Paesani F Chemical Reviews, 116(13), 7501, 2016 |
| 6 |
Isoflurane does not aggregate inside POPC bilayers at high pressure: Implications for pressure reversal of general anaesthesia Wieteska JR, Welche PRL, Tu KM, ElGamacy M, Csanyi G, Payne MC, Chaue PL Chemical Physics Letters, 638, 116, 2015 |
| 7 |
Oxidative Stress in Cardiovascular Disease Csanyi G, Miller FJ International Journal of Molecular Sciences, 15(4), 6002, 2014 |
| 8 |
Proteomic Analysis Identifies an NADPH Oxidase 1 (Nox1)-Mediated Role for Actin-Related Protein 2/3 Complex Subunit 2 (ARPC2) in Promoting Smooth Muscle Cell Migration Al Ghouleh I, Rodriguez A, Pagano PJ, Csanyi G International Journal of Molecular Sciences, 14(10), 20220, 2013 |
| 9 |
Tests of an Adaptive QM/MM Calculation on Free Energy Profiles of Chemical Reactions in Solution Varnai C, Bernstein N, Mones L, Csanyi G Journal of Physical Chemistry B, 117(40), 12202, 2013 |
| 10 |
Topologically Invariant Reaction Coordinates for Simulating Multistate Chemical Reactions Mones L, Csanyi G Journal of Physical Chemistry B, 116(51), 14876, 2012 |