المؤلفون: Enrico Trizio (11373919), Michele Parrinello (240049)

مصطلحات موضوعية: Biophysics, Infectious Diseases, Virology, Space Science, Environmental Sciences not elsewhere classified, Biological Sciences not elsewhere classified, Mathematical Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, Information Systems not elsewhere classified, often allow reducing, multistep chemical processes, previous discrimination approaches, different metastable basins, efficient collective variables, projected data follows, previous approaches, different basins, collective variables, efficient sampling, state systems, reaction profiles, reaction free, preassigned distribution, neural network, multibasin scenario, latter case, first collect, first check, enhanced sampling

Relation: https://figshare.com/articles/journal_contribution/From_Enhanced_Sampling_to_Reaction_Profiles/16556377

الاتاحة: https://doi.org/10.1021/acs.jpclett.1c02317.s001