FAQs
For questions not addressed by a support solution here, please Contact Us. Please do include a description of the problem as well as your operating system and version.
What can we help you with?
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Why are my H-bond constraints not being taken into account?
… constraint are being recognised as donors/acceptors by checking the list of proton acceptors and donors given in the gold_protein.log file. GOLD will then be biased …
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Why is it not possible to return the crystallographic binding pose of the ligand?
… -typed, or is incorrectly protonated. There are incorrect protein residues. Asn and Gln residues often need to be flipped at the terminal side chain, and His …
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How do I know whether to flip or rotate Ring-NHR, Ring-NR1R2 and protonated carboxylic acids when setting ligand flexibility?
… How do I know whether to flip or rotate Ring-NHR, Ring-NR1R2 and protonated carboxylic acids when setting ligand flexibility? …
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