User 6288f3e087

10-12-2010 01:21:31


I am trying to find the references that you used for the descriptors, but I cannot find a place where you have those. Is there a page where you have all of these? So far, I've only been able to find references for logp in a response in the forums. 

Thanks for the help!

ChemAxon 40e8f9506d

11-12-2010 13:06:33

Dear Rob,

you can find here the list of references collected on a single page:



User 6288f3e087

19-12-2010 16:36:49


Thanks for your reply. It was very helpful. However, I'm still confused about the Acessible surface area (ASA) term. 

One page states it is taken from Ferrara's paper (Ferrara, P,. Apostolakis J., Caflisch A., Proteins 2002, 46, 24-33; doi), while another page shows it is taken from a 2000 J. Med. Chem. publication. 

Once again, thank you for your help.


User 851ac690a0

10-01-2011 11:58:02



Thank you for your notes.

Yes ,you are right , the "Reference" list is not complete on the MSAPlugin site. Only one reference  of the "2D  TPSA" calculation J.Med.Chem. 2000, 43, 3714-3717 is proposed. We are going to  add at least one more  Ferrara's reference, about the "3D ASA" calculation.



User 6288f3e087

10-01-2011 14:16:42


Thank you for clarifying the issue.