Combined Simulation and Mutation Studies to Elucidate Selectivity of Unsubstituted Amphetamine‐like Cathinones at the Dopamine Transporter

著录项

• 来源
  《Molecular informatics》 |2017年第6期|共8页
• 作者

  Seddik Amir; Geerke Daan P.; Stockner Thomas; Holy Marion; Kudlacek Oliver; Cozzi Nicholas V.; Ruoho Arnold E.; Sitte Harald H.; Ecker Gerhard F.;

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• 作者单位

  Department of Pharmaceutical ChemistryUniversity of ViennaAlthanstrasse 14 1090 Vienna Austria;

  AIMMS Division of Molecular ToxicologyVU UniversityDe Boelelaan 1083 1081 HV Amsterdam the;

  Institute of PharmacologyMedical University of ViennaW?hringerstrasse 13a 1090 Vienna Austria;

  Institute of PharmacologyMedical University of ViennaW?hringerstrasse 13a 1090 Vienna Austria;

  Institute of PharmacologyMedical University of ViennaW?hringerstrasse 13a 1090 Vienna Austria;

  Department of Cell and Regenerative BiologyUniversity of Wisconsin School of Medicine and Public;

  Department of NeuroscienceUniversity of Wisconsin School of Medicine and Public Health1300;

  Institute of PharmacologyMedical University of ViennaW?hringerstrasse 13a 1090 Vienna Austria;

  Department of Pharmaceutical ChemistryUniversity of ViennaAlthanstrasse 14 1090 Vienna Austria;

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• 收录信息
• 原文格式 PDF
• 正文语种 eng
• 中图分类 普通生物学;
• 关键词

  monoamine transporters; docking; molecular dynamics; thermodynamic integration; uptake inhibitory assay;

  机译：单胺运输机;对接;分子动力学;热力学集成;摄取抑制测定;