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WEB RESOURCES FOR DISCOVERY AND DEVELOPMENT OF NEW MEDICINES

机译：用于发现和开发新药物的网络资源

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摘要

Modern drug discovery is based on the analysis of information about disease mechanisms, molecular targets, and pharmacological substances, the action of which helps to normalize pathological processes. Existing chemical and biomedical databases have recently been supplemented with many specialized computational resources that provide the means to estimate physicochemical properties, biological activity, toxicity, metabolism, and other characteristics of organic molecules in the early stages of drug development. Easy access to this information via the Internet expands significantly the opportunities for an investigator and, at the same time, poses the problem of selecting the information and computational resources most appropriate to the tasks at hand. This paper provides an overview of biomedical and chemical web resources freely available via the Internet and gives recommendations on their optimal use at various stages in the research and development of safer and more effective medicines.
机译：现代药物发现是基于对疾病机制，分子靶标和药理学物质的信息的分析，其作用有助于使病理过程正常化。最近已经补充了现有的化学和生物医学数据库许多专业的计算资源，这些资源提供了估计药物发育早期阶段的物理化学性质，生物活性，毒性，代谢和有机分子的其他特征的方法。通过Internet轻松访问此信息，显着扩展了调查员的机会，同时构成了选择最适合手头任务的信息和计算资源的问题。本文概述了通过互联网自由提供的生物医学和化学网络资源，并提出了在更安全和更有效的药品的研究和开发中的各个阶段的最佳用途建议。

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