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Page 1
Metadynamics of Paths.
Mandelli D, Hirshberg B, Parrinello M. Mandelli D, et al. Among authors: parrinello m. Phys Rev Lett. 2020 Jul 10;125(2):026001. doi: 10.1103/PhysRevLett.125.026001. Phys Rev Lett. 2020. PMID: 32701329
Proton transfer in heterocycle crystals.
Iannuzzi M, Parrinello M. Iannuzzi M, et al. Among authors: parrinello m. Phys Rev Lett. 2004 Jul 9;93(2):025901. doi: 10.1103/PhysRevLett.93.025901. Epub 2004 Jul 9. Phys Rev Lett. 2004. PMID: 15323930 Free article.
Equilibrium free energies from nonequilibrium metadynamics.
Bussi G, Laio A, Parrinello M. Bussi G, et al. Among authors: parrinello m. Phys Rev Lett. 2006 Mar 10;96(9):090601. doi: 10.1103/PhysRevLett.96.090601. Epub 2006 Mar 7. Phys Rev Lett. 2006. PMID: 16606249
Assessing the accuracy of metadynamics.
Laio A, Rodriguez-Fortea A, Gervasio FL, Ceccarelli M, Parrinello M. Laio A, et al. Among authors: parrinello m. J Phys Chem B. 2005 Apr 14;109(14):6714-21. doi: 10.1021/jp045424k. J Phys Chem B. 2005. PMID: 16851755
Enhanced sampling in the well-tempered ensemble.
Bonomi M, Parrinello M. Bonomi M, et al. Among authors: parrinello m. Phys Rev Lett. 2010 May 14;104(19):190601. doi: 10.1103/PhysRevLett.104.190601. Epub 2010 May 10. Phys Rev Lett. 2010. PMID: 20866953
From metadynamics to dynamics.
Tiwary P, Parrinello M. Tiwary P, et al. Among authors: parrinello m. Phys Rev Lett. 2013 Dec 6;111(23):230602. doi: 10.1103/PhysRevLett.111.230602. Epub 2013 Dec 3. Phys Rev Lett. 2013. PMID: 24476246
Well-tempered metadynamics converges asymptotically.
Dama JF, Parrinello M, Voth GA. Dama JF, et al. Among authors: parrinello m. Phys Rev Lett. 2014 Jun 20;112(24):240602. doi: 10.1103/PhysRevLett.112.240602. Epub 2014 Jun 18. Phys Rev Lett. 2014. PMID: 24996077
395 results