(1) what a fingerprint is & how it's represented in the model?
It’s a simply binary vector of 0s and 1s [0,1,1,0,0,0 ….]
The length is usually 2048, but can be 512 or more.
(2) how the model's being fit - ordinary least squares or maximum-likelihood estimation procedures are scale-equivariant.
For model fitting different regression models from sklearn: ort KernelRidge
Ridge, LinearRegression, SVR, KNeighborsRegressor, GaussianProcessRegressor, MLPRegressor, GradientBoostingRegressor, RandomForestRegressor but also TPOTRegressor (http://epistasislab.github.io/tpot/using/) which may have ot…
It’s a simply binary vector of 0s and 1s [0,1,1,0,0,0 ….]
The length is usually 2048, but can be 512 or more.
(2) how the model's being fit - ordinary least squares or maximum-likelihood estimation procedures are scale-equivariant.
For model fitting different regression models from sklearn: ort KernelRidge
Ridge, LinearRegression, SVR, KNeighborsRegressor, GaussianProcessRegressor, MLPRegressor, GradientBoostingRegressor, RandomForestRegressor but also TPOTRegressor (http://epistasislab.github.io/tpot/using/) which may have ot…