Robust estimation of diffusion-optimized ensembles for enhanced sampling

Pengfei Tian, Sigurður Ægir Jónsson, Jesper Ferkinghoff-Borg, Sergei V . Krivov, Kresten Lindorff-Larsen, Anders Irbäck, Wouter Krogh Boomsma

10 Citationer (Scopus)

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Mathematics

Engineering

Biochemistry, Genetics and Molecular Biology

Chemical Engineering