ACFIS 2.0

server for fragment-based drug discovery. ACFIS 2.0 implements an efficient simulation engine to generate large-scale protein conformations for dynamic drug discovery.

Fragment-based drug discovery
One-Stop Mode
    OR
    Example of PDB File: PDB file / Result

         Note: The uploaded complex structure could be experimentally or computational (e.g. using molecular docking approach). If the experimental protein 3D structures are not available, predictive protein structures derived from AlphaFold or homology modeling could be tried.

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