Anisotropic reaction field correction for long-range electrostatic interactions in molecular dynamics simulations
dc.contributor.author
Sidler, Dominik
dc.contributor.author
Frasch, Simon
dc.contributor.author
Cristofol-Clough, Michael
dc.contributor.author
Riniker, Sereina
dc.date.accessioned
2018-07-04T10:28:29Z
dc.date.available
2018-07-03T06:31:23Z
dc.date.available
2018-07-03T16:34:09Z
dc.date.available
2018-07-04T10:28:29Z
dc.date.issued
2018-06-20
dc.identifier.issn
0021-9606
dc.identifier.issn
1089-7690
dc.identifier.other
10.1063/1.5007132
en_US
dc.identifier.uri
http://hdl.handle.net/20.500.11850/273471
dc.language.iso
en
en_US
dc.publisher
American Institute of Physics
en_US
dc.title
Anisotropic reaction field correction for long-range electrostatic interactions in molecular dynamics simulations
en_US
dc.type
Journal Article
dc.date.published
2018-06-20
ethz.journal.title
The Journal of Chemical Physics
ethz.journal.volume
148
en_US
ethz.journal.issue
23
en_US
ethz.journal.abbreviated
J. chem. phys.
ethz.pages.start
234105
en_US
ethz.size
16 p.
en_US
ethz.grant
Computer simulation of small organic molecules for computer-aided drug design
en_US
ethz.identifier.wos
ethz.identifier.scopus
ethz.publication.place
Melville, NY
en_US
ethz.publication.status
published
en_US
ethz.leitzahl
ETH Zürich::00002 - ETH Zürich::00012 - Lehre und Forschung::00007 - Departemente::02020 - Dep. Chemie und Angewandte Biowiss. / Dep. of Chemistry and Applied Biosc.::02543 - Inst. f. Molekulare Physikalische Wiss. / Institute of Molecular Physical Science::09458 - Riniker, Sereina Z. / Riniker, Sereina Z.
ethz.leitzahl.certified
ETH Zürich::00002 - ETH Zürich::00012 - Lehre und Forschung::00007 - Departemente::02020 - Dep. Chemie und Angewandte Biowiss. / Dep. of Chemistry and Applied Biosc.::02543 - Inst. f. Molekulare Physikalische Wiss. / Institute of Molecular Physical Science::09458 - Riniker, Sereina Z. / Riniker, Sereina Z.
ethz.grant.agreementno
159713
ethz.grant.agreementno
159713
ethz.grant.fundername
SNF
ethz.grant.fundername
SNF
ethz.grant.funderDoi
10.13039/501100001711
ethz.grant.funderDoi
10.13039/501100001711
ethz.grant.program
Projekte MINT
ethz.date.deposited
2018-07-03T06:31:36Z
ethz.source
SCOPUS
ethz.eth
yes
en_US
ethz.availability
Metadata only
en_US
ethz.rosetta.installDate
2018-07-04T10:28:34Z
ethz.rosetta.lastUpdated
2024-02-02T05:12:53Z
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true
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