Dear Open Babel users, I'm writing a script to reconstruct a complex of two peptides. I employ OB python interface and also Pybel to make necessary transformations of both peptides, but finally I have to perform energy minimization of the whole complex to avoid bumping of side chains.It seems to
Have you tried H1 + H2? Actually this wasn't working for me in perl, but
it's supposed to be working in Python.
Pozdrawiam, | Best regards,
Maciek Wójcikowski
mac...@wojcikowski.pl
W dniu 23 kwietnia 2012 13:52 użytkownik Чугунов Антон
batc...@yandex.runapisał:
Dear Open Babel users,
