Response to comment on 'Valid molecular dynamics simulations of human hemoglobin require a surprisingly large box size'

We recently reported that molecular dynamics simulations for hemoglobin require a surprisingly large box size to stabilize the T(0) state relative to R(0), as observed in experiments (El Hage et al., 2018). Gapsys and de Groot have commented on this work but do not provide convincing evidence that t...

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书目详细资料
Main Authors: Krystel El Hage, Florent Hédin, Prashant K Gupta, Markus Meuwly, Martin Karplus
格式: 文件
语言:English
出版: eLife Sciences Publications Ltd 2019-06-01
丛编:eLife
主题:
在线阅读:https://elifesciences.org/articles/45318