MolProp TK 2.4.4¶
Minor bug fixes¶
The definition for the SMARTS for the CBoring (straight-chain alkane) fragment in the filter fragment set has been changed from
[CR0H2][CH2][CH2][CH2,H3]
to[CR0H2][CH2][CH2][CH2,CH3]
. Previously, it could erroneously match a heteroatom at the last position.
Documentation changes¶
Minor corrections to the bibliography have been made.