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Journal of Chemical Information and Modeling
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December 28, 2012
MM/GBSA binding energy prediction on the PDBbind data set: successes, failures, and directions for further improvement
Paulette A Greenidge, Christian Kramer, Jean-Christophe Mozziconacci, et al.
The Journal of Organic Chemistry
|
August 21, 2013
Synthesis of all four stereoisomers of 3-(tert-butoxycarbonyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic acid
Bettina Bakonyi, Markus Furegati, Christian Kramer, et al.
Drug Discovery Today
|
January 4, 2020
Multiscale modelling of drug mechanism and safety
Jitao David Zhang, Lisa Sach-Peltason, Christian Kramer, et al.
Journal of Medicinal Chemistry
|
April 18, 2014
Matched molecular pair analysis: significance and the impact of experimental uncertainty
Christian Kramer, Julian E Fuchs, Steven Whitebread, et al.
Journal of Chemical Information and Modeling
|
June 2, 2016
Protease Inhibitors in View of Peptide Substrate Databases
Birgit J Waldner, Julian E Fuchs, Michael Schauperl, et al.
Journal of Breath Research
|
January 28, 2016
Prediction of blood:air and fat:air partition coefficients of volatile organic compounds for the interpretation of data in breath gas analysis
Christian Kramer, Paweł Mochalski, Karl Unterkofler, et al.
Journal of Chemical Information and Modeling
|
December 6, 2013
Deriving static atomic multipoles from the electrostatic potential
Christian Kramer, Tristan Bereau, Alexander Spinn, et al.
Plos Computational Biology
|
November 19, 2013
Substrate-driven mapping of the degradome by comparison of sequence logos
Julian E Fuchs, Susanne von Grafenstein, Roland G Huber, et al.
The Journal of Physical Chemistry. B
|
April 9, 2013
Scoring multipole electrostatics in condensed-phase atomistic simulations
Tristan Bereau, Christian Kramer, Fabien W Monnard, et al.
Plos One
|
November 13, 2015
Characterizing Protease Specificity: How Many Substrates Do We Need?
Michael Schauperl, Julian E Fuchs, Birgit J Waldner, et al.
Page
of 7
Search research articles
Search
Showing results (31-40 of 61) with videos related to
Sort By:
Page
of 7
Journal of Chemical Information and Modeling
|
December 28, 2012
MM/GBSA binding energy prediction on the PDBbind data set: successes, failures, and directions for further improvement
Paulette A Greenidge, Christian Kramer, Jean-Christophe Mozziconacci, et al.
The Journal of Organic Chemistry
|
August 21, 2013
Synthesis of all four stereoisomers of 3-(tert-butoxycarbonyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic acid
Bettina Bakonyi, Markus Furegati, Christian Kramer, et al.
Drug Discovery Today
|
January 4, 2020
Multiscale modelling of drug mechanism and safety
Jitao David Zhang, Lisa Sach-Peltason, Christian Kramer, et al.
Journal of Medicinal Chemistry
|
April 18, 2014
Matched molecular pair analysis: significance and the impact of experimental uncertainty
Christian Kramer, Julian E Fuchs, Steven Whitebread, et al.
Journal of Chemical Information and Modeling
|
June 2, 2016
Protease Inhibitors in View of Peptide Substrate Databases
Birgit J Waldner, Julian E Fuchs, Michael Schauperl, et al.
Journal of Breath Research
|
January 28, 2016
Prediction of blood:air and fat:air partition coefficients of volatile organic compounds for the interpretation of data in breath gas analysis
Christian Kramer, Paweł Mochalski, Karl Unterkofler, et al.
Journal of Chemical Information and Modeling
|
December 6, 2013
Deriving static atomic multipoles from the electrostatic potential
Christian Kramer, Tristan Bereau, Alexander Spinn, et al.
Plos Computational Biology
|
November 19, 2013
Substrate-driven mapping of the degradome by comparison of sequence logos
Julian E Fuchs, Susanne von Grafenstein, Roland G Huber, et al.
The Journal of Physical Chemistry. B
|
April 9, 2013
Scoring multipole electrostatics in condensed-phase atomistic simulations
Tristan Bereau, Christian Kramer, Fabien W Monnard, et al.
Plos One
|
November 13, 2015
Characterizing Protease Specificity: How Many Substrates Do We Need?
Michael Schauperl, Julian E Fuchs, Birgit J Waldner, et al.
Page
of 7