SCHRODINGER Partner's Website

LigPrep 3.8

    LigPrep is a robust collection of tools designed to prepare high quality, all-atom 3D structures
for large numbers of drug-like molecules, starting with 2D or 3D structures in SD or Maestro
format. The resulting structures can be saved in either SD or Maestro format. The simplest use
of LigPrep produces a single, low-energy, 3D structure with correct chiralities for each
successfully processed input structure. LigPrep can also produce a number of structures from
each input structure with various ionization states, tautomers, stereochemistries, and ring
conformations, and eliminate molecules using various criteria including molecular weight or
specified numbers and types of functional groups present.

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  Rancher Catalog

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  Rancher Extension

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  Cloud-Native Network Function

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  SUSE Edge

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  High Availability

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  Virtualization Ready

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