Date: Thu, 25 Jul 2024 09:26:33 +0000
Hi all,
I am using antechamber to generate a prepi file needed for another program. The ligands contain oxetane and azetidine rings and the O/N atoms are assigned 'oq' and 'nl' respectively that are not supported by the other program.
Does anyone have any advice about these atom types? Would it matter if I used gaff vs gaff2? Can I manually change them to a different atom type?
Thank you,
Daniella
Daniella Hares | PhD Student
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