Search results for "NAMI-A"

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An omics perspective to the molecular mechanisms of anticancer metallo-drugs in the computational microscope era

2017

Introduction: Metallo-drugs have attracted enormous interest for cancer treatment. The achievements of this drug-type are summarized by the success story of cisplatin. That being said, there have been many drawbacks with its clinical use, which prompted decades worth of research efforts to move towards safer and more effective agents, either containing platinum or different metals. Areas covered: In this review, the authors provide an atomistic picture of the molecular mechanisms involving selected metallo-drugs from structural and molecular simulation studies. They also provide an omics perspective, pointing out many unsettled aspects of the most relevant families of metallo-drugs at an ep…

Computer scienceAntineoplastic AgentsNanotechnologyMolecular simulation010402 general chemistryQM/MM01 natural sciencesmetadynamicsEpigenesis Geneticmetallo-drugNeoplasmsDrug DiscoveryHumansComputer SimulationplatinumrutheniumSettore CHIM/03 - Chimica Generale e InorganicaG-quadruplex010405 organic chemistryNAMI-AnucleosomePerspective (graphical)free energy calculationsDNAData sciencemolecular dynamics0104 chemical sciencesCancer treatmentMetalscopperDrug DesignComputer-Aided DesignCisplatinExpert Opinion on Drug Discovery
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