Schrцdinger是计算化学领域的科学领导者,为生命科学和材料研究提供软件解决方案和服务。Schrцdinger旨在提供真正满足客户需求的集成软件解决方案和服务。我们希望通过先进的计算技术,改变化学家设计化合物和材料的方式,让世界各地的研究人员能够实现他们改善人类健康和生活质量的目标。通过构建和部署突破性的科学软件解决方案并形成协作和伙伴关系,我们帮助科学家加快他们的研发活动,降低成本,并做出否则可能无法实现的新发现。

Schrцdinger软件套件是一个药物设计软件,使用基于配体和结构的方法。Schrцdinger提供精确、可靠和高性能的计算技术来解决生命科学研究中的实际问题。它为新药候选物的设计、选择和优化提供卓越的解决方案和服务。Schrцdinger’s预测模型将使药物发现科学家能够在发现过程的早期评估化合物的性质,并选择具有最佳特征的候选药物。Schrцdinger’s软件的预测能力使科学家能够加快他们的研究和开发活动,降低研究成本,并做出其他计算或实验方法可能无法实现的新发现。

Schrodinger提供致力于解决药物研究中挑战的完整软件套装。对于以结构为基础的药物设计,Prime是一款精确蛋白质结构预测软件包;Glide执行准确,迅速的配体-受体对接;Liaison预测结合与亲和力;QSite用来研究蛋白质活性区域内的反应机制;Schrödinger还提供Phase用于作基于配体的药效建模,QikProp用于候选药物的ADME性状预测。另外,LigPrep是一款用于深度计算机分析配体库准备的快速2D至3D转换程序。最近,Schrödinger还引入CombiGlide用于焦点库设计,引入Epik对生物环境中的配体质子化状态做精确枚举。 此外,Schrödinger还提供利用计算化学最新技术的产品。Jaguar,高性能初始量子力学组件,MacroModel,分子模拟领域最受信赖的名字,已经广泛地应用于从材料到生命科学等全面的化学研究中。Strike是一款用于检查组织性能关系的化学方法统计程序包。 Maestro是所有Schrödinger计算机程序的用户接口,提供提供强大、充分集成的分子的显现和分析环境

x64 |文件大小:7.25 GB

药物发现
加速线索发现和优化的全面解决方案,已通过我们的合作者在众多目标上的成功验证。

材料科学
化学系统的分子模拟来设计现代生活必需的材料。

制造具有最佳特性的可开发生物分子
使用预测方法设计质量更好的生物分子,从序列到结构对分子进行优化。

利用易处理的基于物理学的工作流程
在一个简化的门户中,可视化结构并访问尖端的预测性计算建模工作流以进行生物发现。

系统需求
操作系统:Windows 10版本,20H2,21H1,21H2/Windows 11版本21H2。
CPU:x86_64兼容处理器
内存:每核4 GB内存
空间:18 GB磁盘空间,用于软件安装;400-500 GB,如果还安装了数据库(PDB、BLAST等)
带有已配置网络接口的网卡
16位颜色(适用于Maestro)

Description
Schrцdinger is a scientific leader in computational chemistry, providing software solutions and services for life sciences and materials research. Schrцdinger aims to provide integrated software solutions and services that truly meet its customers’ needs. We want to empower researchers around the world to achieve their goals of improving human health and quality of life through advanced computational techniques that transform the way chemists design compounds and materials. By building and deploying breakthrough scientific software solutions and forming collaborations and partnerships, we help scientists accelerate their research and development activities, reduce costs, and make novel discoveries that might otherwise not be possible.

Schrцdinger software suite is a drug design software using both ligand and structure-based methods. Schrцdinger provides accurate, reliable, and high performance computational technology to solve real-world problems in life science research. It provides superior solutions and services for the design, selection, and optimization of novel drug candidates. Schrцdinger’s predictive models will enable drug discovery scientists to assess properties of chemical compounds early in the discovery process and to select drug candidates that have optimal profiles. The predictive power of Schrцdinger’s software allows scientists to accelerate their research and development activities, reduce research costs, and make novel discoveries that might not be possible with other computational or experimental approaches.

DRUG DISCOVERY
Comprehensive solutions to accelerate lead discovery and optimization, validated by our collaborators’ success across a wide array of targets.

MATERIALS SCIENCE
Molecular simulations of chemical systems to design materials essential to modern life.

Make developable biomolecules with well-optimized properties
Design better quality biomolecules with predictive methods to optimize molecules from sequence to structure.

Leverage tractable physics-based workflows
Visualize structures and access cutting-edge predictive computational modeling workflows for biologics discovery within a streamlined portal.

System Requirements
OS:Windows 10, versions, 20H2, 21H1, 21H2/Windows 11, version 21H2.
CPU:x86_64 compatible processor
Memory:4 GB memory per core
Space:18 GB disk space for software installation; 400-500 GB if databases (PDB, BLAST, etc) are also installed
Network card with a configured network interface
16-bit color (for Maestro)

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