TY  - GEN
AU  - Schroeter,Timon Sebastian
AU  - Schwaighofer,Anton
AU  - Mika,Sebastian
AU  - Ter Laak,Antonius
AU  - Suelzle,Detlev
AU  - Ganzer,Ursula
AU  - Heinrich,Nikolaus
AU  - Müller,Klaus-Robert
TI  - Estimating the domain of applicability for machine learning QSAR models: a study on aqueous solubility of drug discovery molecules
SN  - 0920-654X
PY  - 2008///0515
KW  - Algorithms
KW  - Artificial Intelligence
KW  - Drug Design
KW  - Pharmaceutical Preparations
KW  - chemistry
KW  - Quantitative Structure-Activity Relationship
KW  - Solubility
KW  - Water
N1  - Publication Type: Journal Article; Research Support, Non-U.S. Gov't
UR  - https://doi.org/10.1007/s10822-007-9160-9
ER  -