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Schrödinger

This category contains 208 nodes.

Ionizer Deprecated

Produces multiple structures for each input structure, with different combinations of ionized states based on the ionizable groups present.

Mol2 Reader Deprecated

Read molecules in Mol2 format

Neutralizer Deprecated

Neutralizes functional groups where possible by adding or removing protons.

Prime Energy Filter Deprecated

Sorts and filters complexes according to Prime Energy.

Prime Refinement Deprecated

The Induced Fit predict sidechains within a distance around the ligand.

Protein Preparation Constrained Refinement Deprecated

The Protein Refinement does a constrained minimization of the protein. Its main purpose is to relax the hydrogens.

Protein Preparation Wizard Deprecated

Preparation of proteins for use in calculations with other Schrödinger products.

Row Iterator Loop Start (deprecated) Deprecated

Iterates over an input data table, whereby each row is passed into the body of the loop.

RRHO Entropy Deprecated

Rigid Rotor Harmonic Oscillator (RRHO)

Run Canvas Deprecated

Launch Canvas