Concepedia
Journal of Ethnopharmacology · 2021 · 50 citations · 42 references
Life SciencesBotanyPharmacologyEthnobotanyInflammationAnti-inflammatory PharmacologyMedicinal Plant KnowledgeMedicinal PlantsAnti-inflammatory ActivityAnti-inflammatory Natural ProductsCyclooxygenase InhibitorsCyclooxygenase-2 PathwayMedicinal Herbs
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Comparison of simple potential functions for simulating liquid water
William L. Jorgensen, Jayaraman Chandrasekhar, Jeffry D. Madura et al. · The Journal of Chemical Physics · 1983 · 42.1K citations
Natural Sciences, Chemistry, Physics +17
SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules
Antoine Daina, Olivier Michielin, Vincent Zoete · Scientific Reports · 2017 · 17.1K citations · Full text
Pharmacy, Medicinal Chemistry, Pharmacokinetics +16
Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
William L. Jorgensen, David S. Maxwell, Julian Tirado‐Rives · Journal of the American Chemical Society · 1996 · 15.3K citations
LigPlot+: Multiple Ligand–Protein Interaction Diagrams for Drug Discovery
Roman A. Laskowski, Mark B. Swindells · Journal of Chemical Information and Modeling · 2011 · 6.5K citations
Life Sciences, Bioinformatics, Medicinal Chemistry +17
pkCSM: Predicting Small-Molecule Pharmacokinetic and Toxicity Properties Using Graph-Based Signatures
Douglas E. V. Pires, Tom L. Blundell, David B. Ascher · Journal of Medicinal Chemistry · 2015 · 5.4K citations · Full text
Pharmacy, Pharmacokinetics, Pharmacology +17