Bond Energies from a Bonds-in-Molecules Neural Network will appear in JPCL
http://pubs.acs.org/doi/abs/10.1021/acs.jpclett.7b01072

Now that IR spectra from Molecular dynamics is working, TensorMol is just about ready for a 0.1 Release! Below is a IR spectrum of water trimer made from realtime dynamics in TensorMol, compared with RI-MP2 stick spectrum.