openmolecules.org Forum: Cheminformatics » Drug Likeness vs Drug Score

Home » DataWarrior » Cheminformatics » Drug Likeness vs Drug Score

Show: Today's Messages :: Polls :: Message Navigator

Re: Drug Likeness vs Drug Score [message #1204 is a reply to message #1203]

Mon, 01 February 2021 18:37

nbehrnd
Messages: 234
Registered: June 2019

Senior Member

The manual's page

http://www.openmolecules.org/properties/properties.html

reads like a druglikeness is computed in first place, subsequently used to compute a drug score.

Lipinski's rule of five properties is one, but not the sole approach to define druglikeness. An implementation other than DataWarrior computing the later and others may be SwissADME (https://doi.org/10.1038/srep42717, open access).

[Updated on: Mon, 01 February 2021 18:38]

Report message to a moderator

[Message index]

		Drug Likeness vs Drug Score By: ELFritzen on Mon, 01 February 2021 17:25
		Re: Drug Likeness vs Drug Score By: nbehrnd on Mon, 01 February 2021 18:37
		Re: Drug Likeness vs Drug Score By: ELFritzen on Tue, 02 February 2021 16:57
		Re: Drug Likeness vs Drug Score By: thomas on Tue, 02 February 2021 23:27
		Re: Drug Likeness vs Drug Score By: ELFritzen on Fri, 05 February 2021 16:42
		Re: Drug Likeness vs Drug Score By: ELFritzen on Tue, 09 February 2021 16:26

Previous Topic:	Acidic oxygen
Next Topic:	Visualising SMILES string

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Thu Jul 31 18:22:01 CEST 2025

Total time taken to generate the page: 0.09046 seconds