Shushan He

Can't kekulize mol due to what appears to be a Boost Error

3

Hi, I was trying to coarse-grain a small drug molecule tenofovir with SMILES "CC(CN1C=NC2=C1N=CN=C2N)OCP(=O)(O)O" For some reason it does not work and returns the following message: [16:13:49] Can't kekulize mol....