Promiscuity progression of bioactive compounds over time

por Hu, Ye, Jasial, Swarit, Bajorath, Jürgen
Publicado 2015

Determining the Degree of Promiscuity of Extensively Assayed Compounds

por Jasial, Swarit, Hu, Ye, Bajorath, Jürgen
Publicado 2016

Extracting Compound Profiling Matrices from Screening Data

por Vogt, Martin, Jasial, Swarit, Bajorath, Jürgen
Publicado 2018

Computationally derived compound profiling matrices

por Vogt, Martin, Jasial, Swarit, Bajorath, Jürgen
Publicado 2018

Activity-relevant similarity values for fingerprints and implications for similarity searching

por Jasial, Swarit, Hu, Ye, Vogt, Martin, Bajorath, Jürgen
Publicado 2016

Interpretation of Ligand-Based Activity Cliff Prediction Models Using the Matched Molecular Pair Kernel

por Tamura, Shunsuke, Jasial, Swarit, Miyao, Tomoyuki, Funatsu, Kimito
Publicado 2021

Prediction of Compound Profiling Matrices Using Machine Learning

por Rodríguez-Pérez, Raquel, Miyao, Tomoyuki, Jasial, Swarit, Vogt, Martin, Bajorath, Jürgen
Publicado 2018

Chemometrics Approach Based on Wavelet Transforms for the Estimation of Monomer Concentrations from FTIR Spectra

por Wakiuchi, Araki, Jasial, Swarit, Asano, Shigehito, Hashizume, Ryo, Hatanaka, Miho, Ohnishi, Yu-ya, Matsubara, Takamitsu, Ajiro, Hiroharu, Sugawara, Tetsunori, Fujii, Mikiya, Miyao, Tomoyuki
Publicado 2023