Speedy SMILES Organic Subset Molecules Filter Streamable

Node to remove rows with molecules containing non-organic subset elements

Speedy SMILES Organic Subset Molecules Splitter Streamable

Node to remove rows with molecules containing non-organic subset elements

Dense To Sparse Streamable

This node converts 'Dense' binary (bitvector) or count (bytevector) fingerprints to the corresponding 'Sparse' representation

Force Field Conformer Energies Streamable

This node calculates Force Fields

PDB Connector Query Executor 

Node to execute an advanced RCSB query

Sparse To Dense Streamable

This node converts 'Sparse' binary (bitvector) or count (bytevector) fingerprints to the corresponding 'Dense' representation

Fingerprint OR Streamable

Perform logic OR operation on a pair of binary (bitvector) fingerprint columns

Type Streamable

This node calculates the fingerprint type

Fingerprint AND Streamable

Perform logic AND operation on a pair of binary (bitvector) fingerprint columns

Fingerprint XOR Streamable

Perform logic XOR operation on a pair of binary (bitvector) fingerprint columns