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

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...

書誌詳細
主要な著者:	Krystel El Hage, Florent Hédin, Prashant K Gupta, Markus Meuwly, Martin Karplus
フォーマット:	論文
言語:	English
出版事項:	eLife Sciences Publications Ltd 2019-06-01
シリーズ:	eLife
主題:	hemoglobin molecular dynamics hydrophobic effect box size
オンライン･アクセス:	https://elifesciences.org/articles/45318

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