Design of novel antituberculosis compounds using graph-theoretical and substructural approaches

The increasing resistance of Mycobacterium tuberculosis to the existing drugs has alarmed the worldwide scientific community. In an attempt to overcome this problem, two models for the design and prediction of new antituberculosis agents were obtained. The first used a mixed approach, containing des...

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Veröffentlicht in:	Molecular diversity 2009-11, Vol.13 (4), p.445-458
Hauptverfasser:	Planche, Alejandro Speck, Scotti, Marcus Tulius, López, América García, de Paulo Emerenciano, Vicente, Pérez, Enrique Molina, Uriarte, Eugenio
Format:	Artikel
Sprache:	eng
Schlagworte:	Antitubercular Agents - chemistry Antitubercular Agents - pharmacology Antituberculosis Biochemistry Biomedical and Life Sciences Discriminant analysis Drug Design Drug resistance Fragment contributions Full Length Paper Graph-theoretical descriptors Life Sciences Massive screening Models, Molecular Molecular structure Mycobacterium tuberculosis Organic Chemistry Pharmaceutical sciences Pharmacy Polymer Sciences Prescription drugs ROC Curve Structure-Activity Relationship Tuberculosis
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