Anamika Singh Gaur

Computational platform Way2Drug: from the prediction of biological activity to drug repurposing

D.S. Druzhilovskiy, Anastasia V. Rudik, Dmitry Filimonov et al. · Russian Chemical Bulletin · 2017 · 125 citations

Biological Activity, Medicinal Chemistry, Drug Repositioning +12

Molecular descriptor analysis of approved drugs using unsupervised learning for drug repurposing

Sita Sirisha Madugula, Lijo John, Selvaraman Nagamani et al. · Computers in Biology and Medicine · 2021 · 38 citations

Drug Repositioning, Engineering, Drug Target +13

A perspective on the nature of cation-π interactions

Nandan Kumar, Anamika Singh Gaur, G. Narahari Sastry · Journal of Chemical Sciences · 2021 · 36 citations

Engineering, Cation-π Interactions, Physics +7

Assessing therapeutic potential of molecules: molecular property diagnostic suite for tuberculosis $$(\mathbf{MPDS}^{\mathbf{TB}})$$ ( MPDS TB )

Anamika Singh Gaur, Anshu Bhardwaj, Arun Sharma et al. · Journal of Chemical Sciences · 2017 · 24 citations

Molecular property diagnostic suite for diabetes mellitus (MPDSDM): An integrated web portal for drug discovery and drug repurposing

Anamika Singh Gaur, Selvaraman Nagamani, Karunakar Tanneeru et al. · Journal of Biomedical Informatics · 2018 · 22 citations

Molecular Characterization, Pharmaceutical Research, Engineering +11