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It helps generate novel ideas and. 利用SYNTHIA™可以轻松自定义搜索条件,对已知或者全新分子进行合成路线设计。 针对每个分析步骤,SYNTHIA™不仅仅关注反应中的 局部相互作用,还考虑整个分子以及 潜在冲突 和选择性问题,还. SYNTHIA™逆合成软件建立在有机合成规则和算法的庞大数据库之上,可以高效搜索合成目标分子的可行路径,加速药物发现进程。
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结论 Synthia是一款先进的AI赋能小分子化合物逆合成路线设计软件,为化学合成领域带来了新的变革。 它不仅提高了化合物合成路线设计的效率,准确性,降低了研发成本,还为新药研发、复杂化合物合. These algorithms enable chemists to. SYNTHIA™是一款逆合成路线设计软件,它由有机化学家联合计算机专家对化学反应的规则和逻辑进行编码,将编码后的反应规则储存在SYNTHIA™的数据库中,历经19年精心设计,该.
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SYNTHIA ® 逆合成软件由有机化学家和计算机科学家历经 21 年精心设计而成,它还利用了化学中人工智能 (AI) 的力量,为计算机辅助合成设计优化合成路线收集信息和预测反应。 课题组对由人工智能驱动的计算机辅助合成软件SYNTHIA™(更名前叫Chematica)加以改进,使得进阶版的SYNTHIA™可以为复杂的天然产物设计合成路径,并通过类似于人机对比的图灵. Synthia ® retrosynthesis software, designed by a team of chemists and computer scientists over a span of 21 years, is powered by advanced algorithms