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Can I read Balloon Manual on EtoBox?
Balloon Manual by Jose Gonzalez is a document available to read on EtoBox.
What is Balloon Manual about?
This document provides usage examples and options for the Balloon software which generates conformers of small molecules. Key information includes that it requires a forcefield parameter file location, can generate ensembles of conformations or single structures from SMILES, and has options for energy minimization, partial charge assignment, and using a genetic algorithm for conformer sampling.
- Author
- Jose Gonzalez
- Language
- EN