Vijaya Hinge

Employment

• University of Alberta

Education

• Indian Institute of Technology Bombay PhD
• University of Hyderabad Masters

Projects & Funding

Projects & funding information is unavailable.

Publications (5)

• Prediction of P-glycoprotein inhibitors with machine learning classification models and 3D-RISM-KH theory based solvation energy descriptors
  Journal of Computer-Aided Molecular Design 2019 DOI: 10.1007/s10822-019-00253-5
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• To Pass or Not To Pass: Predicting the Blood–Brain Barrier Permeability with the 3D-RISM-KH Molecular Solvation Theory
  ACS Omega 2019 DOI: 10.1021/acsomega.9b01512
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• The role of hydration effects in 5-fluorouridine binding to SOD1: insight from a new 3D-RISM-KH based protocol for including structural water in docking simulations
  Journal of Computer-Aided Molecular Design 2019 DOI: 10.1007/s10822-019-00239-3
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• Predicting skin permeability using the 3D-RISM-KH theory based solvation energy descriptors for a diverse class of compounds
  Journal of Computer-Aided Molecular Design 2019 DOI: 10.1007/s10822-019-00205-z
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• Predicting Blood–Brain Partitioning of Small Molecules Using a Novel Minimalistic Descriptor-Based Approach via the 3D-RISM-KH Molecular Solvation Theory
  ACS Omega 2019 DOI: 10.1021/acsomega.8b03328
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