(5) Drugs designing and synthesizing;
In the field of drug design, the protein K-Ras is legendary.
That's a general strategy for drug design.
The Department of Drug Design and Pharmacology.
PH2112 Principles of drug design.Combinations with other parts of speech
Determining these interactions is critical for drug design.
Division of Drug Design.
Opportunities for structure-based design of protease-directed drugs.
Structure of a hantavirus protein as a promising model for drug design.
Protein structure modeling and design of drugs.它被广泛应用于蛋白质工程、合理药物设计和生物药品生产这些以开发稳定的蛋白质为关键目标的领域。
It has wide application in protein engineering, rational drug design and biopharmaceutical production, where developing stable proteins is a critical goal.药物设计的策略通常分为两种--基于配体的药物设计(LBDD)和基于结构的药物设计(SBDD)。
Computer-aided drug design(CADD) is of two types of structure-based drug design(SBDD) and ligand-based drug design(LBDD).但是药物设计被认为是一件非常困难的事情,它被认为是超越了当前人工智能的能力。
But drug design has been considered such a difficult thing to do it was thought to be beyond the capability of current AI.计算机辅助药物设计包括计算方法和资源,用于促进新的治疗方案的设计和发现。
Computer-aided drug design comprises computational methods and resources that are used to facilitate the design and discovery of new therapeutic solutions.其次,“虚拟病人”可以在药物设计和优化中发挥作用,潜在地降低药物开发成本。
Secondly, the“virtual patient” can play a role in drug design and optimization, potentially lowering drug-development costs.这些不完整的模型限制了药物设计,限制了我们对工业溶剂反应的理解,并促使科学家研究水的一些异常特征。
These incomplete models restrict drug design and limit our understanding of industrial solvent reactions, fueling scientists to investigate some of water's anomalous characteristics.研究还可以扩展到其他数据驱动领域,如健康分析,生物信息学,蛋白质结构预测,药物设计和系统生物学。
Research can also be extended to other data-driven areas, such as health analytics, bioinformatics,protein structure prediction, drug design, and systems biology.可以用传统的方法来确定先导化合物,然后用合理药物设计技术对其进行优化。
Traditional approaches may be used to identify a lead compound,which can then be optimised using rational drug design techniques.与水的相互作用决定了药物分子如何与靶标结合,但是模拟这些相互作用是困难的,限制了药物设计的准确性。
Interactions with water dominate how drug molecules bind to targets, but it's tricky to model these interactions,limiting the accuracy of drug design.他们热衷于用它来研究水的异常性质,看它是否能提高药物设计的准确性。
They're keen to use it to investigate the anomalous properties of water,and to see if it improves drug design accuracy.第二年提供的课程在应用基因技术,蛋白质组学,药物设计,生物信息学和大规模数据分析。
The second year offers courses in applied gene technology,proteomics, drug design, and bioinformatics analysis of large-scale data.一份数字新闻稿指出,它是“利用云计算和新型计算方法的力量来改造药物设计过程。
A Numerate press release states that it is"leveraging the power of cloud computing andnovel computational methods to transform the drug design process.".在不同图(Graph)上的机器学习是一项重要且无处不在的任务,其应用范围从药物设计到社交网络中的好友推荐。
Machine learning on graphs is an important andubiquitous task with applications ranging from drug design to friendship recommendation in social networks.成品时,该模型,可以用于探索的蛋白质的作用机制和基于结构的药物设计。
The model, when refined,can be used to explore the mechanism of action of the protein and for structure-based drug design.希望较大的备选化合物(包括小分子与生物制剂)在进入非临床安全测试前,还要经历药物设计和优化工序。
Promising candidate compounds(both small molecules and biologics), undergo drug design and optimization before entering non-clinical safety testing.发表在“自然”杂志上的图片揭示了关于受体的分子细节,该受体可以改善药物设计以治疗多种疾病。
Images published in Nature revealmolecular details about the receptor that could improve drug design to treat a multitude of diseases.HTS与HCS“HTS”和“HCS”都是药物设计技术中使用的主要工具。
HTS” and“HCS” are both main tools used in the drug designing technology.药物设计的这一途径需要在低效的过程中筛选成千上万的药物。
This pathway to drug design requires screening thousands of drugs in an inefficient process.药物设计的早期发展表明,对够大的文库进行筛选,最后总会找到具有理想特性的生化结构。
Early developments in drug design suggested that if a large enough library was screened, a biochemical structure with desirable characteristics would eventually be found.如果应用于开发药物设计和目标选择,这可以加快我们进行计算机研究的能力。
If applied to develop medicine design and target selection, this could accelerate our ability to do in silico research.