Concepedia
International Journal of Biological Macromolecules · 2011 · 38 citations · 23 references
PharmacyBiochemistryMedicinal ChemistryDrug DesignDrug DiscoveryGlycobiologyEnzyme InhibitionGlycan StructureGlycosylation PathwaysHit-to-lead OptimizationLead Compound Design3D Molecular ModelingGlycan Processing PathwaysGlycan-inspired Drug Design
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A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules
Wendy D. Cornell, Piotr Cieplak, Christopher I. Bayly et al. · Journal of the American Chemical Society · 1995 · 13.1K citations
Natural Sciences, Biochemistry, Biophysics +17
Glide: A New Approach for Rapid, Accurate Docking and Scoring. 1. Method and Assessment of Docking Accuracy
Richard A. Friesner, Jay L. Banks, Robert B. Murphy et al. · Journal of Medicinal Chemistry · 2004 · 9.9K citations
Life Sciences, Biophysics, Medicinal Chemistry +17
A time-efficient, linear-space local similarity algorithm
Xiaoqiu Huang, Webb Miller · Advances in Applied Mathematics · 1991 · 1K citations
Computing, Computer Science, Data Structures +8
A General and Fast Scoring Function for Protein−Ligand Interactions: A Simplified Potential Approach
Ingo Muegge, Yvonne C. Martin · Journal of Medicinal Chemistry · 1999 · 1K citations
Life Sciences, Biochemistry, Biophysics +17
PDBsum more: new summaries and analyses of the known 3D structures of proteins and nucleic acids
Roman A. Laskowski · Nucleic Acids Research · 2004 · 448 citations · Full text
Life Sciences, Biochemistry, Molecular Biology +15