Comments (1)
zhengh96
commented on June 16, 2024
2
Thank you for your suggestion.
We understand that they are different programs with different functions and licenses. However, at the moment, Uni-Dock Tools is required to fully utilize the features available in Uni-Dock, such as using SDF and PDB formats for ligands and receptors.
Additionally, we plan to showcase a series of Uni-Dock usage methods under the Uni-Dock Tools repo, making it more accessible for users to see and learn from. Therefore, we have decided to keep the two programs in one repo for the time being.
We DO have plans for building a more user-friendly interface for Uni-Dock in the future. And when the time is appropriate, we will consider splitting the repos as you suggested.
We appreciate your understanding and contribution to the project!
from uni-dock.
Related Issues (20)
- Potential array index out of range. HOT 1
- MCDock Run Rigid Docking with Incorrect Input SDF Files
- How to get score when run unidock tooks? HOT 4
- cmake -B build -D FETCH_BOOST=ON does not fetch boost HOT 6
- Compiling error on CUDA 11
- 1.1.1 source release contains version string 1.1.0 HOT 1
- Error in vina score HOT 2
- typo in examples HOT 1
- missing installation instruction in unidock_tools
- How to dock
- WARNING: Could not find any conformations
- run unidock, report segmentation fault while using file index
- OOM using ad4 scoring function
- CUDA Runtime Error when using ad4 maps HOT 4
- Fail on screening test case mmp13 on version v1.1.x HOT 2
- Unidock pipeline fails to read ligand index HOT 1
- target_compile_features no known features for CXX compiler HOT 6
- Unknown order of ligands in the output HOT 2
- in ligand index, unable to find mol file, only first without others. HOT 1
- Seed doesn't seem to be working properly. HOT 3
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