Computational Molecular Bioscience

Bacterial Heavy Metal Resistance Genes and Bioremediation Potential

Hannah L. Johnson, Hyuk Cho, Madhusudan Choudhary · 2019 · 37 citations · Full text

Life Sciences, Bioinformatics, Microbiology +15

Molecular Docking and Pharmacological Property Analysis of Phytochemicals from <i>Clitoria ternatea</i> as Potent Inhibitors of Cell Cycle Checkpoint Proteins in the Cyclin/CDK Pathway in Cancer Cells

Asad Ullah, Nazmul Islam Prottoy, Yusha Araf et al. · 2019 · 36 citations · Full text

Pharmacy, Oncology, Pharmacology +17

Application of Hartree-Fock Method for Modeling of Bioactive Molecules Using SAR and QSPR

Cleydson B. R. Santos, Cleison C. Lobato, Francinaldo Sarges Braga et al. · 2014 · 33 citations · Full text

Natural Sciences, Chemistry, Medicinal Chemistry +17

Molecular Docking and ADMET Study of Emodin Derivatives as Anticancer Inhibitors of NAT2, COX2 and TOP1 Enzymes

Daniel M. Shadrack, Valence M. K. Ndesendo · 2017 · 25 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

Computational Analysis of Physicochemical, Pharmacokinetic and Toxicological Properties of Deoxyhypusine Synthase Inhibitors with Antimalarial Activity

Nayara S. R. Silva, Luana K. S. Gonçalves, Jonatas Lobato Duarte et al. · 2014 · 22 citations · Full text

Pharmacy, Pharmacokinetics, Pharmacology +17