| Id | 2850 | |
|---|---|---|
| Topology | SAMPL5_047.itp | 8edb4fc5de8de3b563ae626eda5ebb8c1b96b822 |
| Topology | SAMPL5_047.pdb | e1b6fdf6c59ef1c65e128195bd776f972d71bc81 |
Jan Domański, Oliver Beckstein, Bogdan I. Iorga; Ligandbook: an online repository for small and drug-like molecule force field parameters, Bioinformatics, Volume 33, Issue 11, 1 June 2017, Pages 1747–1749, https://doi.org/10.1093/bioinformatics/btx037
"Why Do *You* Use Constraints ?" (H.J.C. Berendsen)
