So i ran into a problem when i first installed autodock and ADT, I didn't have any macromolecule files to dock
After a bit of digging i came across this site and it is awesome (aside from the fact i have yet to get autodock/autogrid fully functioning)
http://www.gpcr.org/7tm/proteinfamily/;jsessionid=6e49ef0ed922cbc383202e663a8b
Does anyone here by chance know of any opensource or freeware that just spits out binding sites for ligands and approx affinities?
On a side note, I was reading about magnolias because there are a lot around where i live and was wondering if they would be a source of any interesting chems: after coming across magnolol and honokiol im curious as to the effects of their possible(?) derived amphetamine compounds.
After a bit of digging i came across this site and it is awesome (aside from the fact i have yet to get autodock/autogrid fully functioning)
http://www.gpcr.org/7tm/proteinfamily/;jsessionid=6e49ef0ed922cbc383202e663a8b
Does anyone here by chance know of any opensource or freeware that just spits out binding sites for ligands and approx affinities?
On a side note, I was reading about magnolias because there are a lot around where i live and was wondering if they would be a source of any interesting chems: after coming across magnolol and honokiol im curious as to the effects of their possible(?) derived amphetamine compounds.