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on-line software
- ALOGPS 2.1* is the most accurate program to predict lipophilicity and aqueous solubility of molecules
- ASNN* calculates highly predictive non-linear neural network models
- E-BABEL is molecular structure information interchange hub
- PNN produces clearly interpretable analytical non-linear models
- PCLIENT generates more than 3000 descriptors
- E-DRAGON calculates DRAGON molecular indices
- PLS implements original two-step descriptors selection procedure
- UFS produces a reduced data set that contains no redundancy and a minimal amount of multicollinearity
If you have any questions, problems to run applets, please, contact Igor V. Tetko.
*standalone version is free for academic and non for profit organisations.
 
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