TY - GEN AU - Brown,Nathan AU - McKay,Ben AU - Gasteiger,Johann TI - A novel workflow for the inverse QSPR problem using multiobjective optimization SN - 0920-654X PY - 2007///0112 KW - Least-Squares Analysis KW - Models, Chemical KW - Quantitative Structure-Activity Relationship KW - Solubility N1 - Publication Type: Journal Article; Research Support, Non-U.S. Gov't UR - https://doi.org/10.1007/s10822-006-9063-1 ER -