MBG wiki
|
RecentChanges
|
Blog
|
2024-11-27
|
2024-11-26
Editing Details for each project
||project||initial pdb||psfgen||minimization||psfgen||solvation/ionization||box size & center|| ||native_qb||1o9y.pdb->remove water->align->rename HIS to HSE->separate chains||[[psfgen.com]]|| - || - ||box size: use molecular dimensions boundary: 2.4A box padding: 15A, Cfinal=0.1M NaCl x Na & y Cl were added, charge before=-20e, charge after=1|| ||native_flin||1o6a.pdb->remove water, multiple conformations & rename MSE to MET->align->rename HIS to HSE->separate chains||[[psfgen.com]]|| - || - ||Cfinal=0.1M NaCl, 14 Na & 7 Cl were added, charge before=-7e, charge after=2.5||(89.96, 66.47, 64.84) & (3.27, -1.29, -0.76)|| ||AD_dimer|| ||BC_dimer|| ||T40I_qb|| ||T40Y_qb|| ||T40W_qb|| ||I41W+qb||
Summary:
This change is a minor edit.
Username:
Replace this text with a file.
![[Home]](/wiki.png)