wednesday

1. lig prediction structure

1.1. confirmation aromatic residue form cyclic from literature

2. specific analysis

2.1. temp

2.1.1. ACTIVE SITE close up

2.1.1.1. RMSD

2.1.1.2. RMSF

2.1.1.3. Dist

2.2. pH

2.2.1. ACTIVE SITE close up

2.2.1.1. RMSD

2.2.1.2. RMSF

2.2.1.3. Dist

3. MD progress

3.1. entrance

3.1.1. pH

3.1.2. mutation

3.1.3. temp

3.2. active site

3.2.1. specific mutation tyr294

3.2.1.1. comparison

3.2.2. multi-mutation

3.2.2.1. refer docking