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Change histogram import

1

Histogram has been removed in `scipy` but is available in `numpy` The requirement `numpy>=1.15.2` covers the import.

renzph

in `utils.chemistry` it references the `histogram` class from copy which no longer exists I exchanged it with `from numpy import histogram` and it seems to work. Is it possible to...

PhillipDowney

I would like to test a molecule generator but I can only use the generated smiles and the training smiles mostly for the distribution evaluation (not goal one), is there...

AlexisGeorgiou

Hi, The ChemNet file name has changed in FCD version 1.2, causing a bug when evaluating this metric in assess_distribution_learning. The new name is 'ChemNet_v0.13_pretrained.pt' (see [here](https://github.com/bioinf-jku/FCD/tree/master/fcd)). The bug is...

asiraudin

it says 'Make start_pop_ranolazine more polar and add a fluorine', but the code is: logP_under_4 = RdkitScoringFunction(descriptor=logP, score_modifier=MaxGaussianModifier(mu=7, sigma=1)) I guess logP_under_4 is a correct name stands for 'trying to...

CandyClass