Nicolas Tielker

Publication Activity (10 Years)

Years Active: 2016-2021
Publications (10 Years): 6

Top Topics

Prediction Error

Theoretical Basis

Electronic Commerce

Lessons Learned

Top Venues

J. Comput. Aided Mol. Des.

Publications

Teresa Danielle Bergazin, Nicolas Tielker, Yingying Zhang, Junjun Mao, Marilyn R. Gunner, Karol Francisco, Carlo Ballatore, Stefan M. Kast, David L. Mobley
, and log D predictions from the SAMPL7 blind challenge. J. Comput. Aided Mol. Des. 35 (7) (2021)
Nicolas Tielker, Lukas Eberlein, Gerhard Hessler, K. Friedemann Schmidt, Stefan Güssregen, Stefan M. Kast
Quantum-mechanical property prediction of solvated drug molecules: what have we learned from a decade of SAMPL blind prediction challenges? J. Comput. Aided Mol. Des. 35 (4) (2021)
Nicolas Tielker, Stefan Güssregen, Stefan M. Kast
SAMPL7 physical property prediction from EC-RISM theory. J. Comput. Aided Mol. Des. 35 (8) (2021)
Nicolas Tielker, Daniel Tomazic, Lukas Eberlein, Stefan Güssregen, Stefan M. Kast
The SAMPL6 challenge on predicting octanol-water partition coefficients from EC-RISM theory. J. Comput. Aided Mol. Des. 34 (4) (2020)
Nicolas Tielker, Lukas Eberlein, Stefan Güssregen, Stefan M. Kast
The SAMPL6 challenge on predicting aqueous pK a values from EC-RISM theory. J. Comput. Aided Mol. Des. 32 (10) (2018)
Nicolas Tielker, Daniel Tomazic, Jochen Heil, Thomas Kloss, Sebastian Ehrhart, Stefan Güssregen, K. Friedemann Schmidt, Stefan M. Kast
. J. Comput. Aided Mol. Des. 30 (11) (2016)