The script pdb2psf works fine for peptides and dna fragments. Is there guidance somewhere for using this script on arbitrary small-molecules, other than amino acids or nucleic acids? Thanks,
Joe R. Feldkamp Modeling & Simulation Innovation Center - NA Kimberly-Clark Corporation phone: 920-721-7348 This e-mail is intended for the use of the addressee(s) only and may contain privileged, confidential, or proprietary information that is exempt from disclosure under law. If you have received this message in error, please inform us promptly by reply e-mail, then delete the e-mail and destroy any printed copy. Thank you.
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