Skip to content

Commit

Permalink
Updated README file
Browse files Browse the repository at this point in the history
  • Loading branch information
amjjbonvin committed Jan 11, 2023
1 parent a096ff0 commit e2fe305
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion README.md
Original file line number Diff line number Diff line change
Expand Up @@ -3,7 +3,6 @@
Docking benchmark 5 (BM5) - cleaned and ready to use for HADDOCK

[![DOI](https://zenodo.org/badge/162272657.svg)](https://zenodo.org/badge/latestdoi/162272657)

This is the docking and binding affinity benchmark described in:

T Vreven, I.H. Moal, A. Vangone, B.G. Pierce, P.L. Kastritis, M. Torchala, R. Chaleil,
Expand Down Expand Up @@ -32,6 +31,7 @@ And for each PDB there is an associated `.info` file providing statistics of the
Various distance restraints files are present:

* `XXX_ambig.tbl` : Ambiguous interaction restraints based on the true interface measured with a 3.9A cutoff
* `XXX_ambig5.tbl`: Ambiguous interaction restraints based on the true interface measured with a 5.0A cutoff
* `XXX_restraint-bodies.tbl` : If present, contains a list of distance restraints to keep unconnected bodies together
* `XXX_XXX_*.tbl` : If present, contains a list of distance restraints to keep the ligand in place in the structure
* `XXX_hbonds.tbl` : the combination of the bodies and ligand distance restraints (used in HADDOCK)
Expand Down

0 comments on commit e2fe305

Please sign in to comment.