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OpenEye Scientific Software Inc oedocking's makereceptor version 3.0.1
Oedocking's Makereceptor Version 3.0.1, supplied by OpenEye Scientific Software Inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/make_receptor+program/oedocking+suite+program+make+receptor+v++3+0+1/pmc05363884-45-10-14
Average 90 stars, based on 1 article reviews
oedocking's makereceptor version 3.0.1 - by Bioz Stars, 2026-09
90/100 stars

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Article Title: Mononuclear copper(II) complexes with 2-thiophene carboxylate and N-N donors; DNA interaction, antioxidant/anti-inflammatory and antitumor activity.
Article Snippet: Redox-active compounds such as copper-phenanthroline are known as artificial/chemical nucleases with a great impact and potential for their applications as metallotherapeutics.. In that vein, the mononuclear copper(II) complexes [Cu(L)2(bipy)] (1), [Cu(L)2(bipy)(H2O)] (2) and [Cu(L)2(phen)(H2O)] (3), where L=2thiophene carboxylate, bipy=2,2 ́-bipyridine and phen=1,10-phenanthroline, have been prepared and pharmacochemically studied, while the crystal structure of 1 is also reported.. All the tested complexes preferably bind to CT-DNA via minor groove as resulted from UV spectroscopy studies, luminescent titration, EB competition assays and viscosity measurements.

Article Title: Targeting on poly(ADP-ribose) polymerase activity with DNA-damaging hybrid lactam-steroid alkylators in wild-type and BRCA1-mutated ovarian cancer cells.
Article Snippet: Conjugated lactam-steroid alkylators (LSA), have been shown to exhibit superior activity at controlling cancer models and overlap drug resistance to conventional chemotherapy.. Hybrid LSAs combine two active compounds in a single molecule and incorporate modified steroids bearing lactam moiety in one or more steroid rings functioning as vectors for cytotoxic agents.. We first describe a novel class of LSAs that generate excellent anticancer activity against UWB1.289 and UWB1.289+BRCA1 human ovarian cancer cell lines.

Article Title: Design, Synthesis and Biological Activity Evaluation of S-Substituted 1 H -5-Mercapto-1,2,4-Triazole Derivatives as Antiproliferative Agents in Colorectal Cancer
Article Snippet: The 3D structures, corresponding to the selected protein targets (Table ), were obtained from the RCSB PDB (Research Collaborative for Structural Bioinformatics Protein Data Bank) and processed with the OEDocking MAKE_RECEPTOR software, version 3.0.1 (OpenEye Scientific Software, Inc.) (Hawkins et al., ).

Article Title: Design, synthesis and pharmaco-toxicological assessment of 5-mercapto-1,2,4-triazole derivatives with antibacterial and antiproliferative activity
Article Snippet: Protein structures were prepared as receptors, suitable for docking, using OEDocking's MakeReceptor version 3.0.1 (OpenEye Scientific Software, Inc.) ( ).

Article Title: Design and Synthesis of Novel Bis-Imidazolyl Phenyl Butadiyne Derivatives as HCV NS5A Inhibitors
Article Snippet: The PDB file was cleaned of water molecules and prepared with the OEDocking Suite program MAKE RECEPTOR v4.0.0.0 (OpenEye Scientific Software, Inc.) [ , ] to give the respective input oed extension file to be used in simulation experiments.

Article Title: Design, Synthesis and Biological Activity Evaluation of S-Substituted 1 H -5-Mercapto-1,2,4-Triazole Derivatives as Antiproliferative Agents in Colorectal Cancer
Article Snippet: For molecular docking, the HYBRID software, version 3.0.1 (OpenEye Scientific Software, Inc.) was used (McGann, ).

Article Title: Synthesis, structure elucidation and biological evaluation of triple bridged dinuclear copper(II) complexes as anticancer and antioxidant/anti-inflammatory agents.
Article Snippet: Please cite this article as: Z. Boulsourani, S. Katsamakas, G.D. Geromichalos, V. Psycharis, C.P.. Raptopoulou, D. Hadjipavlou-Litina, E. Yiannaki, C. Dendrinou-Samara , Synthesis, structure elucidation and biological evaluation of triple bridged dinuclear copper(II) complexes as anticancer and antioxidant/anti-inflammatory agents.. The address for the corresponding author was captured as affiliation for all authors.



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