Schrodinger KNIME Workflows 2018-4

Schrodinger KNIME Workflows 2018-4


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Schrodinger KNIME Workflows 2018-4
File size: 731 MB

These are the contained Suites: 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 Suite
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.

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