Results 171 to 180 of about 75,103 (257)

QSAR machine learning-guided discovery of renieramycin right-half derivatives with cytotoxic activity against NSCLC cells. [PDF]

Sci Rep
Putra ID, Maitarad P, Yokoya M, Ei ZZ, Hotta D, Shi L, Rungrotmongkol T, Chanvorachote P.   +7 more
europepmc   +1 more source

Quantitative Structure-Activity Relationships (QSARs) Within Series of Inhibitors for Mammalian Cytochromes P450 (CYPs) [PDF]

, 2001
David F. Lewis, Maurice Dickins
openalex   +1 more source

Mining Structural Information from Gas Chromatography-Electron-Impact Ionization-Mass Spectrometry Data for Analytical-Descriptor-Based Quantitative Structure-Activity Relationship. [PDF]

J Xenobiot
Zushi Y.
europepmc   +1 more source

THEORETICAL STUDIES ON PYRAZOLE DERIVATIVES AS ANTI-BREAST CANCER AGENTS: DFT, QSAR AND DOCKING METHODS

, 2017
Banjo Semire, Oyebamiji Ak
openalex   +1 more source

3D-QSAR studies on Maslinic acid analogs for Anticancer activity against Breast Cancer cell line MCF-7 [PDF]

, 2017
Sarfaraz Alam, Feroz Khan
openalex   +1 more source

Guidelines for the assessment and control of mutagenic impurities in pharmaceuticals. [PDF]

Genes Environ
Honma M.
europepmc   +1 more source

3D-QSAR and QSSR studies of 3,8-diazabicyclo[4.2.0]octane derivatives as neuronal nicotinic acetylcholine receptors by comparative molecular field analysis (CoMFA)

, 2008
Mao Ye, Marcia I. Dawson
openalex   +1 more source

Modeling the Mutational Effects on Biochemical Phenotypes of SARS-CoV-2 Using Molecular Fields. [PDF]

Biomolecules
Wang B, Xi Z.
europepmc   +1 more source

Development of QSAR Models and Web Applications for Predicting hDHFR Inhibitor Bioactivity Using Machine Learning. [PDF]

Molecules
Maattallaoui I, Sakho M, Maatallaoui A, Catalán EB, Aouad NE.   +4 more
europepmc   +1 more source

Molecular docking and QSAR study on steroidal compounds as aromatase inhibitors

, 2010
Yujie Dai, Qiang Wang, Xiuli Zhang, Shiru Jia, Heng Zheng, Dacheng Feng, Peng Yu   +6 more
openalex   +1 more source