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New methods: general discussion.
Angulo G, Astumian RD, Beniwal V, Bolhuis PG, Dellago C, Ellis J, Ensing B, Glowacki DR, Hammes-Schiffer S, Kästner J, Lelièvre T, Makri N, Manolopoulos D, Menzl G, Miller TF, Mulholland A, Oprzeska-Zingrebe EA, Parrinello M, Pollak E, Proppe J, Reiher M, Richardson J, Roy Chowdhury P, Sanz E, Schütte C, Shalashilin D, Szabla R, Taraphder S, Tiwari A, Vanden-Eijnden E, Vijaykumar A, Zinovjev K. Angulo G, et al. Faraday Discuss. 2016 Dec 22;195:521-556. doi: 10.1039/C6FD90075E. Faraday Discuss. 2016. PMID: 27929586 No abstract available.
Markov state models based on milestoning.
Schütte C, Noé F, Lu J, Sarich M, Vanden-Eijnden E. Schütte C, et al. J Chem Phys. 2011 May 28;134(20):204105. doi: 10.1063/1.3590108. J Chem Phys. 2011. PMID: 21639422
On the assumptions underlying milestoning.
Vanden-Eijnden E, Venturoli M, Ciccotti G, Elber R. Vanden-Eijnden E, et al. J Chem Phys. 2008 Nov 7;129(17):174102. doi: 10.1063/1.2996509. J Chem Phys. 2008. PMID: 19045328 Free PMC article.
68 results