7 Commits

Author	SHA1	Message	Date
Daniel Probst	1d657477a8	Fixed final requests from PR	2020-03-19 23:40:10 +01:00
Daniel Probst	b56bfab46b	Implemented changes based on PR change requests	2020-03-19 21:05:30 +01:00
Daniel Probst	6f4b904a2c	Bugfix	2020-03-03 22:12:04 +01:00
Daniel Probst	02482b8379	Implemented changes per PR comments	2020-03-03 13:39:16 +01:00
Daniel Probst	80f0d93c12	Fixed error in unique_ptrs and replaced another leaking molecule not spotted in the review	2019-09-20 11:02:05 +02:00
Daniel Probst	e30e3318b6	Fixed leaking molecule (when creating submol in CreateShingling). Replaced pointers / delete with unqiue_ptrs. Fixed typo in comments.	2019-09-20 10:32:22 +02:00
Daniel Probst	57ff7849d2	Added MHFP fingerprint implementation	2019-09-12 15:09:51 +02:00