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AtomicFingerprint

Numerical fingerprinting tools for RNA

Quick Start

Install

make clean
make

Example

  • Cavity Distances
label=native
./bin/test -mol2 tests/1aju/cavity_${label}.mol2 tests/1aju/complex_cavity_${label}.pdb > tests/output_${label}.txt
label=decoy
./bin/test -mol2 tests/1aju/cavity_${label}.mol2 tests/1aju/complex_cavity_${label}.pdb > tests/output_${label}.txt
python py/process_dists.py

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Numerical featurization tools for RNA / RNA-ligand systems

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