Question regarding molecule optimization results in Modof #5
Description
First of all, I would like to express my sincere gratitude to you for developing such an incredible tool, Modof, which has greatly enhanced our ability to optimize molecules for drug discovery. However, I encountered an issue during our recent testing of the model. Some optimized molecule after processing appears identical to the original molecule, despite running through the optimization procedure.
python ./model/optimize.py --test /data/chenwenhai/Modof/data/logp06/test.txt --vocab ./data/logp06/vocab.txt --model .6ata/chenwenhai/modof/Modof/experiments/logp/model.iter-7 --save_dir ./out/ --hidden_size 128 --latent_size 16 --depthT 3 --depthG 4 --iternum 5 --num 10 -s 0.6
