Sadra Kashef Ol Gheta
Adiran Garaizar Suarez
Andreas H. Göller
Michael E. Beck
Sadra Kashef Ol Gheta
Katharina Meier
Comparative assessment of physics-based in silico methods to calculate relative solubilities.
36
2024
December
38
J. Comput. Aided Mol. Des.
1
https://doi.org/10.1007/s10822-024-00576-y
db/journals/jcamd/jcamd38.html#SuarezGBGM24
streams/journals/jcamd
Sadra Kashef Ol Gheta
Anne Bonin
Thomas Gerlach
Andreas H. Göller
Predicting absolute aqueous solubility by applying a machine learning model for an artificially liquid-state as proxy for the solid-state.
765-789
2023
December
37
J. Comput. Aided Mol. Des.
12
https://doi.org/10.1007/s10822-023-00538-w
db/journals/jcamd/jcamd37.html#GhetaBGG23
Michael E. Beck
Anne Bonin
Thomas Gerlach
Andreas H. Göller
Katharina Meier
Adiran Garaizar Suarez