Taka
Dear, Recently I'm interested in rdkit minimallib. Thanks for sharing the code! By using the library, I can use RDKit from Rust. And I would like to use find MCS...
Added some changes for python3.5 environment. The code will work with tensorflow1.2.0 /1.3.0 and Keras 2.0
Dear, I tried to run the call back method in python3.5. It did not work and I think the reason is following line. api.py lines = ["%s: %s" % (v,...
Dear Developer, Is there any option for reaction mapping from list of reaction smiles? Currently I have file of reaction list and I would like to map many reactions. Any...
Dear @bp-kelley , Thanks for developing really useful package for chemoinforomatics. I think to_np function should return array. Best, Taka, @iwatobipen
Dear, Thanks for sharing uself chemoinformaitcs package of Rust! I would like to ask you if I could build the code with rdkit which is installed from conda. By using...
Dear developer, I would like to ask you that do you have plan to support RDKit for structure handling in the package like openffTK? Thanks, Taka
Dear developer, Is it possible to render network with another layout which is not defined in original? Any advice, suggestions will be greatly appreciated. Thanks, Taka
Dear developer, I would like to make an interactive visualization with the library. Is it possible to implement tool tip or another action when user click node or edge? Any...