Published March 2, 2025 | Version v1
Dataset Open

CycleDesigner Molecular Dynamics Simulation Data

Creators

Description

Cycledesigner Leveraging RFdiffusion and HighFold to Design Cyclic Peptide Binders for Specific Targets.
The output trajectory files of molecular dynamics simulation prosess.
the only md3.nc file with no PDB title is 4kel_md3.

Files

Files (40.6 GB)

Name Size Download all
md5:632c8703d3bd542e3f9bab4fb25eca0a
3.3 GB Download
md5:d7da2acff9cca6626a04646932a27c4b
2.6 GB Download
md5:fb52322fddc4e9b04a3b60a75c05c07e
2.9 GB Download
md5:363de1ffffc5f6579336e01e4f47f3e5
2.9 GB Download
md5:0089e5e6c3d19bfdac558dd947f0094e
2.9 GB Download
md5:924e3ec5e0b77c4ad953f96a2da92d5a
2.5 GB Download
md5:1f4789a323a0b17c2496dfd86f94f429
2.5 GB Download
md5:97321e6e7f2ebc8bc5728b1038272b25
2.4 GB Download
md5:5603458d5dd1f815c7d84be1ba6906ba
2.6 GB Download
md5:7a7cac2c39dc13b113ae3bb373d23f78
2.6 GB Download
md5:43d5ef971e05b2a7ad4d6a0853efb4aa
2.6 GB Download
md5:986ce5ea48690fea6bc47bbd54bfe242
2.5 GB Download
md5:9813b51e06b5f6ccbb6055fa3ec6bfcd
2.5 GB Download
md5:e258867ca68a82b68819f013fe1b737d
2.5 GB Download
md5:353a6549e49da766514f1e91c4076bdf
3.3 GB Download