Individual and collective human intelligence in drug design: evaluating the search strategy

Table 7 Number of scoring function calls needed to reach the target molecules of five different complexity levels

Complexity level	Number of scoring function calls to reach the target molecule
Complexity level	lstm_smiles	Human individual	Human collective
L1	132,838	3614	1956
L2	132,846	–^a	4271
L3	138,209	–^a	5404
L4	139,221	–^a	4591
L5	140,339	–^a	12,118

Human individual design results are only reported for the experiment where participants reached the target molecule
^aTarget molecule not reached

ISSN: 1758-2946