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Efficient sampling of atomic configurational spaces.
Pártay LB, Bartók AP, Csányi G. Pártay LB, et al. Among authors: csanyi g. J Phys Chem B. 2010 Aug 19;114(32):10502-12. doi: 10.1021/jp1012973. J Phys Chem B. 2010. PMID: 20701382
QM/MM simulation of liquid water with an adaptive quantum region.
Bernstein N, Várnai C, Solt I, Winfield SA, Payne MC, Simon I, Fuxreiter M, Csányi G. Bernstein N, et al. Among authors: csanyi g. Phys Chem Chem Phys. 2012 Jan 14;14(2):646-56. doi: 10.1039/c1cp22600b. Epub 2011 Nov 16. Phys Chem Chem Phys. 2012. PMID: 22089416
Nested sampling for materials: the case of hard spheres.
Pártay LB, Bartók AP, Csányi G. Pártay LB, et al. Among authors: csanyi g. Phys Rev E Stat Nonlin Soft Matter Phys. 2014 Feb;89(2):022302. doi: 10.1103/PhysRevE.89.022302. Epub 2014 Feb 6. Phys Rev E Stat Nonlin Soft Matter Phys. 2014. PMID: 25353467
163 results