Sfoglia per Autore
In Silico prediction of cytochrome P450-drug interaction: QSARs for CYP3a4 and CYP2C9
2016 Nembri, S; Grisoni, F; Consonni, V; Todeschini, R
CERAPP: Collaborative estrogen receptor activity prediction project
2016 Mansouri, K; Abdelaziz, A; Rybacka, A; Roncaglioni, A; Tropsha, A; Varnek, A; Zakharov, A; Worth, A; Richard, A; Grulke, C; Trisciuzzi, D; Fourches, D; Horvath, D; Benfenati, E; Muratov, E; Wedebye, E; Grisoni, F; Mangiatordi, G; Incisivo, G; Hong, H; Ng, H; Tetko, I; Balabin, I; Kancherla, J; Shen, J; Burton, J; Nicklaus, M; Cassotti, M; Nikolov, N; Nicolotti, O; Andersson, P; Zang, Q; Politi, R; Beger, R; Todeschini, R; Huang, R; Farag, S; Rosenberg, S; Slavov, S; Hu, X; Judson, R
Investigating the mechanisms of bioconcentration through QSAR classification trees
2016 Grisoni, F; Consonni, V; Vighi, M; Villa, S; Todeschini, R
Application of the weighted Power-Weakness Ratio (wPWR) as a fusion rule in Ligand-Based virtual screening
2016 Cassotti, M; Grisoni, F; Nembri, S; Todeschini, R
Beware of Unreliable Q2! A Comparative Study of Regression Metrics for Predictivity Assessment of QSAR Models
2016 Todeschini, R; Ballabio, D; Grisoni, F
A new concept of higher-order similarity and the role of distance/similarity measures in local classification methods
2016 Todeschini, R; Ballabio, D; Consonni, V; Grisoni, F
Expert QSAR system for predicting the bioconcentration factor under the REACH regulation
2016 Grisoni, F; Consonni, V; Vighi, M; Villa, S; Todeschini, R
How to weight Hasse matrices and reduce incomparabilities
2015 Grisoni, F; Consonni, V; Nembri, S; Todeschini, R
Weighted power-weakness ratio for multi-criteria decision making
2015 Todeschini, R; Grisoni, F; Nembri, S
QSAR models for bioconcentration: Is the increase in the complexity justified by more accurate predictions?
2015 Grisoni, F; Consonni, V; Villa, S; Vighi, M; Todeschini, R
How to weight Hasse matrices and reduce incomparabilities
2015 Grisoni, F; Consonni, V; Nembri, S; Todeschini, R
QSAR models for bioconcentration: is the increase in the complexity balanced by better predictions?
2014 Grisoni, F; Consonni, V; Villa, S; Vighi, M; Todeschini, R
Reshaped sequential replacement algorithm: an efficient approach to variable selection
2014 Todeschini, R; Cassotti, M; Grisoni, F
Reshaped Seuqnetial Replacement for variable selection in QSPR: comparison with other reference methods
2014 Grisoni, F; Cassotti, M; Todeschini, R
Reshaped Sequential Replacement algorithm: an efficient approach to variable selection
2014 Cassotti, M; Grisoni, F; Todeschini, R
Reshaped Sequential Replacement algorithm: an efficient approach to variable selection
2013 Cassotti, M; Grisoni, F; Todeschini, R
A comparative study on different methods for applicability domain assessment
2013 Consonni, V; Ballabio, D; Sahigara, F; Mauri, A; Cassotti, M; Grisoni, F; Todeschini, R
Reshaped sequential replacement algorithm (RSR) for variable selection
2013 Grisoni, F; Cassotti, M; Todeschini, R
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