About: Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking

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About: Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking Goto Sponge NotDistinct Permalink

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scientific article published on 01 April 2006

Attributes	Values
rdf:type	Item
description	wetenschappelijk artikel (nl) наукова стаття, опублікована у квітні 2006 (uk) artículu científicu espublizáu n'abril de 2006 (ast) scientific article published on 01 April 2006 (en)
publication date	wds:Q83147842-5B011F8B-6DD5-436E-A2BA-A5E3B5610EBE
publication date	2006-04-01 00:00:00Z (xsd:dateTime)
author name string	wds:Q83147842-13F0777D-3378-4A5F-838B-689601E1E27E wds:Q83147842-1CFFD931-2CF3-417E-839D-EDA92A8F54BE wds:Q83147842-2427EE90-2C28-4799-B870-C06919FE1077 wds:Q83147842-2CC70EF4-A4BD-496B-9B59-3C195EE45E21 wds:Q83147842-7B552B5B-44AE-453E-9CD9-691C2568C21C wds:Q83147842-827D5520-EDBA-4B87-8018-8402D54CB16A wds:Q83147842-956053D2-93B1-4FDE-B4BC-2992CC81D1B4 wds:Q83147842-B638D90C-4420-4C27-90FC-87E6257A3E8C wds:Q83147842-B739C0D9-E1EE-4BCA-933A-E861EEFB8ECA wds:Q83147842-BCCF713A-EF49-47C3-AF03-76E9215E5591 wds:Q83147842-BF3CA724-6AE9-4207-80C3-74FE5D9323EF wds:Q83147842-F868B9A6-D74F-4E3E-AF5A-E01A677CF7D6
author name string	Hui Xu Min Zhang Jie Zhu Yunlong Song Chunquan Sheng Jianzhong Yao Wannian Zhang Zhenyuan Miao Youjun Zhou Jiaguo Lü Jü Zhu Qingfen Jiang
rdfs:label	Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking (en) Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking (nl)
skos:prefLabel	Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking (en) Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking (nl)
name	Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking (en) Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking (nl)
author	wds:Q83147842-99772766-FA86-47D3-9766-0C2F143086F3
author	Haitao (mark) Ji
title	wds:Q83147842-26C1AE2F-760B-4581-848D-1AEFA25DFA47
title	Structure-based optimization of azole antifungal agents by CoMFA, CoMSIA, and molecular docking (en)
page(s)	wds:Q83147842-1CF9BDCD-B11D-4C72-A598-D77A68D60C36
page(s)	2512-2525
instance of	wds:Q83147842-F08011FA-EF68-442F-843A-39F2099EE503
instance of	scholarly article
PubMed ID	wds:Q83147842-F949F3CA-3B4B-480B-95D6-26378F7B1CD1
PubMed ID	http://rdf.ncbi.nlm.nih.gov/pubchem/reference/16610794
PubMed ID	16610794
published in	wds:Q83147842-5DDD3F46-5287-48E2-A6C5-EC21CEAC5718
published in	Journal of Medicinal Chemistry
issue	wds:Q83147842-7584984E-38D9-4E7B-85EE-F2BE23B83D0A
volume	wds:Q83147842-9B94DD31-0DA7-44CB-9F65-C887F40B22BD
issue	8
volume	49
DOI	wds:Q83147842-E487B332-BC6A-452A-94A9-43DBE557FAAB
DOI	http://dx.doi.org/10.1021/JM051211N
DOI	10.1021/JM051211N
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q83147842
is cites work of	Impact of Absolute Stereochemistry on the Antiangiogenic and Antifungal Activities of Itraconazole Evaluation of the performance of 3D virtual screening protocols: RMSD comparisons, enrichment assessments, and decoy selection--what can we learn from earlier mistakes? Effect of quinoline based 1,2,3-triazole and its structural analogues on growth and virulence attributes of Candida albicans Novel carboline derivatives as potent antifungal lead compounds: design, synthesis, and biological evaluation Software and resources for computational medicinal chemistry X-ray Structure of 4,4'-Dihydroxybenzophenone Mimicking Sterol Substrate in the Active Site of Sterol 14 -Demethylase (CYP51) A combined 3D-QSAR and molecular docking strategy to understand the binding mechanism of (V600E)B-RAF inhibitors. Triazole derivatives with improved in vitro antifungal activity over azole drugs Three-dimensional model of lanosterol 14 alpha-demethylase from Cryptococcus neoformans: active-site characterization and insights into azole binding Improved model of lanosterol 14alpha-demethylase by ligand-supported homology modeling: validation by virtual screening and azole optimization Design and synthesis of novel xyloketal derivatives and their protective activities against H2O2-induced HUVEC injury Design, synthesis, and biological evaluation of 1-[(biarylmethyl)methylamino]-2-(2,4-difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-2-ols as potent antifungal agents: new insights into structure-activity relationships Design, synthesis, and in vitro antifungal activity of 1-[(4-substituted-benzyl)methylamino]-2-(2,4-difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-2-ols Evolutionary trace analysis of CYP51 family: implication for site-directed mutagenesis and novel antifungal drug design From antidiabetic to antifungal: discovery of highly potent triazole-thiazolidinedione hybrids as novel antifungal agents Design, synthesis, and antifungal activities of novel triazole derivatives containing the benzyl group Synthesis and antifungal activity of novel triazole compounds containing piperazine moiety. A Double-Activity (Green Algae Toxicity and Bacterial Genotoxicity) 3D-QSAR Model Based on the Comprehensive Index Method and Its Application in Fluoroquinolones' Modification Structural basis for heterogeneous phenotype of ERG11 dependent Azole resistance in C.albicans clinical isolates 2-Amino-nonyl-6-methoxyl-tetralin muriate inhibits sterol C-14 reductase in the ergosterol biosynthetic pathway
is cites work of	wds:Q33590335-9B6387EB-26B0-4A87-9A46-CE2E5008D421 wds:Q38280950-70FF598C-21D2-4611-892B-ACFFA706CB1B wds:Q37701941-73F8B4D6-E2DE-4259-97FC-EA3DDFC614C4 wds:Q43161102-F770F568-5E42-4F95-96D5-58A33B170B42 wds:Q85266370-B7EDD286-D26D-475E-9398-056BD5DC9686 wds:Q42747611-6F233398-92A2-4EA7-B498-D3207AAADE19 wds:Q37057393-DA7EE89D-F746-4568-8EA5-3C0E5A460FC0 wds:Q35184974-53A460AB-51D7-49BF-970C-247FEF5856D5 wds:Q34543717-F5EFB487-C089-4927-BE80-8E8EACEADD79 wds:Q37274762-66C46F58-4275-4AD4-BB3F-06A9CAA53407 wds:Q33556437-985137B3-4746-474D-8E77-97056FEE12E3 wds:Q56897153-52840C33-F24C-47E7-B94D-389299116364 wds:Q35131496-0BEA1FF6-6EAE-4CBB-A460-44BC750E4E04 wds:Q33636471-BF0B9E04-0FC6-4946-8C4B-4E4672BE0A98 wds:Q54478395-95EE76B5-0C1A-4567-9853-D5E0E535D2CF wds:Q28728561-C594DC77-2C08-4AFB-8F64-96FDAB846762 wds:Q27650159-1AF39B0E-C593-4581-94F4-7A1E807D43AB wds:Q35218682-74CEF328-34F7-45B8-A77E-DD6031624B87 wds:Q39729792-4DE15A9D-7326-4737-B232-32701E7E0AE8 wds:Q89578667-30B6EF89-A513-4E8E-AE6B-64FCFB92BBC9

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