Re: [Rdkit-discuss] reaction fingerprint as bitstring

2017-03-24 Thread Ambrish
your point I am loosing information in this way. Any suggestion on how it can be done ? On Fri, Mar 24, 2017 at 3:08 AM Greg Landrum <greg.land...@gmail.com> wrote: > Hi Ambrish, > > Assuming that I understand correctly what you want to do, here's an > example us

[Rdkit-discuss] reaction fingerprint as bitstring

2017-03-23 Thread Ambrish
Hi RDKitters, I am trying to calculate reaction fingerprints and store it in database. The transformation fingerprint created using the routine below is a IntSparseIntVect and I would like to convert it to a BitString of a particular length. How do we do that . def