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How to do an evaluation: pitfalls and traps.
Hawkins PC, Warren GL, Skillman AG, Nicholls A. Hawkins PC, et al. Among authors: skillman ag. J Comput Aided Mol Des. 2008 Mar-Apr;22(3-4):179-90. doi: 10.1007/s10822-007-9166-3. Epub 2008 Jan 23. J Comput Aided Mol Des. 2008. PMID: 18217218 Free PMC article. Review.
The SAMPL2 blind prediction challenge: introduction and overview.
Geballe MT, Skillman AG, Nicholls A, Guthrie JP, Taylor PJ. Geballe MT, et al. Among authors: skillman ag. J Comput Aided Mol Des. 2010 Apr;24(4):259-79. doi: 10.1007/s10822-010-9350-8. Epub 2010 May 9. J Comput Aided Mol Des. 2010. PMID: 20455007
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