Zobrazeno 1 - 10
of 130
pro vyhledávání: '"Uwe Ebert"'
Publikováno v:
Environmental Science & Technology. 57:976-984
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7a9821db192c11cba485a54aa13b8aea
https://doi.org/10.1021/acs.est.2c06170
https://doi.org/10.1021/acs.est.2c06170
Publikováno v:
Environmental Science & Technology. 57:160-167
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::cafe6f45d4f84673ae05bd0120793ab6
https://doi.org/10.1021/acs.est.2c05623
https://doi.org/10.1021/acs.est.2c05623
Publikováno v:
Rechtsmedizin. 31:62-66
ZusammenfassungEin erfahrener Jäger kehrte nach einem Abendansitz auf Rehwild nicht nach Hause zurück. Er wurde am folgenden Morgen von seinem Sohn auf einem Feld, in einer Blutlache liegend, tot aufgefunden. Neben ihm lag ein toter Rehbock. Der J
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6956913d83e33b8bf2d62a70c45421bc
https://doi.org/10.1007/s00194-020-00422-z
https://doi.org/10.1007/s00194-020-00422-z
Publikováno v:
CHIMIA, Vol 60, Iss 10 (2006)
A large number of models is available to predict physicochemical properties directly from the two-dimensional molecular structure. An alternative to conventional fragment methods is given by linear free-energy relationships (LFERs) employing Abraham
Externí odkaz:
https://doaj.org/article/1a132f92fd4844b3ba001d61581d109b
Publikováno v:
Environment International, Vol 88, Iss, Pp 123-132 (2016)
The threshold of toxicological concern (TTC) of a compound represents an exposure value below which the associated human health risk is considered negligible. As such, this approach offers assessing the risk of potential toxicants when little or no t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6020fb300057e33334fc9b1c5fef872a
https://doi.org/10.1016/j.envint.2015.12.005
https://doi.org/10.1016/j.envint.2015.12.005
Autor:
Ralph Kühne, Peter C. von der Ohe, Ralf-Uwe Ebert, Werner Brack, Nadin Ulrich, Gerrit Schüürmann
Publikováno v:
Molecular Informatics. 32:108-120
According to the European REACH Directive, the acute daphnid toxicity needs to be assessed for industrial chemicals with market volumes � 1 t/a. Employing a data set of 1365 organic compounds with experimental 48-h LC50 data for Daphnia magna, a re
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6f47e7bf2cc42d358f095dc07883d454
https://doi.org/10.1002/minf.201200085
https://doi.org/10.1002/minf.201200085
Publikováno v:
Environmental Science & Technology. 45:4616-4622
Read-across enables the interpolation of a property for a target chemical from respective experimental data of sufficiently similar compounds. Employing a set of 692 organic compounds with experimental values for the 96 h fish toxicity toward the fat
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ce3ceff8a7125f08cb1beafd1393d1d2
https://doi.org/10.1021/es200361r
https://doi.org/10.1021/es200361r
Publikováno v:
Journal of Physical Organic Chemistry. 24:1072-1080
Hydrogen bonding has a great impact on the partitioning of organic compounds in biological and environmental systems as well as on the shape and functionality of macromolecules. Electronic characteristics of single molecules, localized at the H-bond
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f9e5ef7fc66192a24119e95085f48239
https://doi.org/10.1002/poc.1834
https://doi.org/10.1002/poc.1834
Publikováno v:
Theoretical Chemistry Accounts. 127:355-367
The molecular orbital OH (MOOH) approach is a perturbational quantum chemical method to predict rate constants of OH radical reactions with organic compounds. Going beyond previous AM1 parameterizations, a first ab initio implementation employing the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2bf8a38d517e9a7b578795a26b32f969
https://doi.org/10.1007/s00214-009-0724-8
https://doi.org/10.1007/s00214-009-0724-8
Publikováno v:
The Journal of Physical Chemistry A. 113:10104-10112
Hydrogen bonding affects the partitioning of organic compounds between environmental and biological compartments as well as the three-dimensional shape of macromolecules. Using the semiempirical quantum chemical AM1 level of calculation, we have deve
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::058a28595d53dcae190347693d6fae17
https://doi.org/10.1021/jp904812b
https://doi.org/10.1021/jp904812b