wangyu-sd/RetroExplainer
RetroExplainer: A chemical knowledge and deep-leaning guided molecular assembly approach for retrosynthesis prediction with quantitative interpretability
PythonMIT
Issues
- 0
Inquiry about Adaptations in Retro* for One-Step Model in RetroExplainer
#17 opened by danielFarfan18 - 6
ct_prob和batch[ct_target]数量不匹配
#9 opened by starhou - 2
练50K数据集生成的leaving_group的维度与测试时的维度不匹配
#11 opened by l727248517 - 0
Pytorch-lightning version issue
#16 opened by HowardLi1984 - 1
requirements.txt missing
#13 opened by venukm - 4
some issues found when trying to process data
#8 opened by yz103 - 1
the check_reac function is missing
#7 opened by zhuhr213 - 0
how to assemble
#15 opened by Honllin - 0
- 0
TypeError: stat: path should be string, bytes, os.PathLike or integer, not NoneType
#12 opened by 28YOGESH - 0
- 1
- 3
is it possible to predict topk routes?
#5 opened by hongxianglics - 2
- 2
- 2
access denied
#2 opened by hongxianglics - 1
wrong check points
#1 opened by hongxianglics