What conformer generation settings are the most loose / have highest success rate? #7360
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j-adamczyk
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I am interested in generating conformers. As a fallback, if more precise methods fail (e.g. default ETKDGv3 settings), I want to tweak settings to make the least constraints and the highest chance of generating any conformer. I don't require particularly precise one, just to get any conformer.
What settings of EmbedMolecule should I set to maximize the chances of generating a conformer? Apart from very high
maxAttempts, of course.Beta Was this translation helpful? Give feedback.
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