Sharing Data from Molecular Simulations

Mark Abraham; Rossen Apostalov; Jonathan Barnoud; Paul Bauer; Christian Blau; Alexander Bonvin; Matthieu Chavent; John Chodera; Karmen Čondić-Jurkić; Lucie Delemotte; Helmut Grubmüller; Rebecca Howard; E Joseph Jordan; Erik Lindahl; O H Samuli Ollila; Jana Selent; Johanna Tiemann; Danial Smith; Phillip Stansfeld; Mikael Trellet; Christopher J Woods; Artem Zhmurov

Sharing Data from Molecular Simulations

Mark Abraham
, Rossen Apostalov
, Jonathan Barnoud
, Paul Bauer
, Christian Blau
, Alexander Bonvin
, Matthieu Chavent^*
, John Chodera
, Karmen Čondić-Jurkić
, Lucie Delemotte
, Helmut Grubmüller
, Rebecca Howard
, E Joseph Jordan
, Erik Lindahl
, O H Samuli Ollila
, Jana Selent
, Johanna Tiemann
, Danial Smith
, Phillip Stansfeld
, Mikael Trellet

Christopher J Woods, Artem Zhmurov

^*Corresponding author for this work

School of Chemistry

Research output: Contribution to journal › Article (Academic Journal) › peer-review

37 Citations (Scopus)

Original language	English
Pages (from-to)	4093-4099
Journal	Journal of Chemical Information and Modeling
Volume	59
Issue number	10
Publication status	Published - 17 Sept 2019

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https://chemrxiv.org/articles/Sharing_Data_from_Molecular_Simulations/9775493Licence: CC BY-NC-ND

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Cite this

Abraham, M., Apostalov, R., Barnoud, J., Bauer, P., Blau, C., Bonvin, A., Chavent, M., Chodera, J., Čondić-Jurkić, K., Delemotte, L., Grubmüller, H., Howard, R., Jordan, E. J., Lindahl, E., Ollila, O. H. S., Selent, J., Tiemann, J., Smith, D., Stansfeld, P., ... Zhmurov, A. (2019). Sharing Data from Molecular Simulations. Journal of Chemical Information and Modeling, 59(10), 4093-4099. https://chemrxiv.org/articles/Sharing_Data_from_Molecular_Simulations/9775493

@article{1024242e2c6b4fa0a0a94f6a28181543,

title = "Sharing Data from Molecular Simulations",

author = "Mark Abraham and Rossen Apostalov and Jonathan Barnoud and Paul Bauer and Christian Blau and Alexander Bonvin and Matthieu Chavent and John Chodera and Karmen {\v C}ondi{\'c}-Jurki{\'c} and Lucie Delemotte and Helmut Grubm{\"u}ller and Rebecca Howard and Jordan, \{E Joseph\} and Erik Lindahl and Ollila, \{O H Samuli\} and Jana Selent and Johanna Tiemann and Danial Smith and Phillip Stansfeld and Mikael Trellet and Woods, \{Christopher J\} and Artem Zhmurov",

year = "2019",

month = sep,

day = "17",

language = "English",

volume = "59",

pages = "4093--4099",

journal = "Journal of Chemical Information and Modeling",

issn = "1549-9596",

publisher = "American Chemical Society",

number = "10",

}

Abraham, M, Apostalov, R, Barnoud, J, Bauer, P, Blau, C, Bonvin, A, Chavent, M, Chodera, J, Čondić-Jurkić, K, Delemotte, L, Grubmüller, H, Howard, R, Jordan, EJ, Lindahl, E, Ollila, OHS, Selent, J, Tiemann, J, Smith, D, Stansfeld, P, Trellet, M, Woods, CJ & Zhmurov, A 2019, 'Sharing Data from Molecular Simulations', Journal of Chemical Information and Modeling, vol. 59, no. 10, pp. 4093-4099. <https://chemrxiv.org/articles/Sharing_Data_from_Molecular_Simulations/9775493>

TY - JOUR

T1 - Sharing Data from Molecular Simulations

AU - Abraham, Mark

AU - Apostalov, Rossen

AU - Barnoud, Jonathan

AU - Bauer, Paul

AU - Blau, Christian

AU - Bonvin, Alexander

AU - Chavent, Matthieu

AU - Chodera, John

AU - Čondić-Jurkić, Karmen

AU - Delemotte, Lucie

AU - Grubmüller, Helmut

AU - Howard, Rebecca

AU - Jordan, E Joseph

AU - Lindahl, Erik

AU - Ollila, O H Samuli

AU - Selent, Jana

AU - Tiemann, Johanna

AU - Smith, Danial

AU - Stansfeld, Phillip

AU - Trellet, Mikael

AU - Woods, Christopher J

AU - Zhmurov, Artem

PY - 2019/9/17

Y1 - 2019/9/17

M3 - Article (Academic Journal)

SN - 1549-9596

VL - 59

SP - 4093

EP - 4099

JO - Journal of Chemical Information and Modeling

JF - Journal of Chemical Information and Modeling

IS - 10

ER -