Hi,
Predict_FX has worked quite well in our hands for that purpouse but you
have to pay for a licence. It is currently commercialized by Certara:
http://www.certara.com/products/molmod/predictfx
Regards,
Zsolt Böcskei
sanofi
Paris
2013/10/14 Rose, Peter
> You may use similarity to kn
Hi,
A few weeks ago, I have already cited renin as such an example. With two
slightly differerent molecules in the asu, certain inhibitors bind only to
one of them and the other renin molecule is empty.
Look at 2G24 for example in the PDB.
Molecule A is loaded, while B is empty. The difference in
