pHaseMD4AI
pHaseMD4AI
Phase-Space MD Dataset

Explore systems

Browse curated peptide and protein systems by sequence, PDB ID, modification type, and protonation-state annotation.

Showing 501–503 of 503

Search supports sequence or PDB ID. Use [PTM] after an amino acid for modified residues, e.g. AR[CBM]A. Use * after a protonated residue for CpHMD, e.g. AH*H*A. Current Type / PTM / CpHMD filters will be kept.

Due to the accuracy limits of implicit solvent models, we only simulated the first chain of the protein corresponding to each PDB ID.

Class
PTM
CpHMD
SystemLengthModificationpH ConditionMethodsStructure
3BMX617
—
0.0–12.5
UnbiasedCpHMD
3BMX structure
View
3TSP646
—
0.0–12.5
UnbiasedCpHMD
3TSP structure
View
4RKU721
—
0.0–12.5
UnbiasedCpHMD
4RKU structure
View
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