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Items: 8

1.

Multiple protein structures and multiple ligands: effects on the apparent goodness of virtual screening results.

Sheridan RP, McGaughey GB, Cornell WD.

J Comput Aided Mol Des. 2008 Mar-Apr;22(3-4):257-65. doi: 10.1007/s10822-008-9168-9.

PMID:
18273559
2.

Community benchmarks for virtual screening.

Irwin JJ.

J Comput Aided Mol Des. 2008 Mar-Apr;22(3-4):193-9. doi: 10.1007/s10822-008-9189-4. Review.

PMID:
18273555
3.

Managing bias in ROC curves.

Clark RD, Webster-Clark DJ.

J Comput Aided Mol Des. 2008 Mar-Apr;22(3-4):141-6. doi: 10.1007/s10822-008-9181-z.

PMID:
18256892
4.

What do we know and when do we know it?

Nicholls A.

J Comput Aided Mol Des. 2008 Mar-Apr;22(3-4):239-55. doi: 10.1007/s10822-008-9170-2. Review.

5.

Evaluation of the performance of 3D virtual screening protocols: RMSD comparisons, enrichment assessments, and decoy selection--what can we learn from earlier mistakes?

Kirchmair J, Markt P, Distinto S, Wolber G, Langer T.

J Comput Aided Mol Des. 2008 Mar-Apr;22(3-4):213-28. doi: 10.1007/s10822-007-9163-6. Review.

PMID:
18196462
6.

Evaluating docking programs: keeping the playing field level.

Liebeschuetz JW.

J Comput Aided Mol Des. 2008 Mar-Apr;22(3-4):229-38. doi: 10.1007/s10822-008-9169-8.

PMID:
18196461
7.
8.

Lead-like, drug-like or "Pub-like": how different are they?

Oprea TI, Allu TK, Fara DC, Rad RF, Ostopovici L, Bologa CG.

J Comput Aided Mol Des. 2007 Jan-Mar;21(1-3):113-9.

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