药物发现分析软件Schrodinger

药物发现分析软件Schrodinger Suites 2015-

2+KNIME Workflows

Schrodinger Suites 2015-2+KNIME Workflows Win/Mac/Linux

⼩分⼦药物发现套件

从QSAR到虚拟筛选结合亲和⼒的预测，综合⼩分⼦药物。 发现套件包含必要的fragment-，配体，以及基于结构的药物设计⽤于引导发现和优化的所有⼯具。

Biologics⽣物套件

这种新的，易于使⽤的套件是从底层设计是所有的都在模拟⽣物，抗体和蛋⽩质的重要⼯具的第⼀个完整的集合。

材料科学套件

这种创新的新套件提供了灵活和强⼤的⼯具，量⼦⼒学为基础的模拟化学系统，使系统的分析和优化，在特种化学品和材料科

学应⽤。

信息发现套件

作为新⼀代平台的协同药物设计允许多学科的团队，包括药物化学家，⽣物学家建模和IT专业⼈员，共享，查看和管理实时数

据。 PyMOL

PyMOL是⼀个开放源代码的基础⽤户发起的分⼦可视化系统。通过购买订阅维护和/或⽀持，请⽀持这个开放的，有效的，和

负担得起的软件开发。-------------------------------------------Small-Molecule Drug Discovery Suite.

From QSAR to virtual screening to binding affinity predictions, the comprehensive Small-Molecule Drug.

Discovery Suite contains all the tools necessary for fragment-, ligand-, and structure-based drug design for lead discovery

and optimization.

Biologics Suits

This new, easy-to-use suite is designed from the ground up to be the first complete collection of all the tools that are

important in modeling biologics, antibodies, and proteins.

Materials Science Suite

This innovative new suite provides versatile and powerful tools for the quantum mechanics-based simulation of chemical

systems, enabling the analysis and optimization of systems with applications in specialty chemicals and materials science.

Discovery Informatics Suite

A next-generation platform for collaborative drug design allows multi-disciplinary teams, including medicinal chemists,

biologists modelers, and IT professionals, to share, view, and manage data in real time.

PyMOL

PyMOL is a user-sponsored molecular visualization system on an open-source foundation. Please support development of

this open, effective, and affordable software by purchasing a subscription to maintenance and/or support.