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name: Bug report | ||
about: Create a bug report to help improve this project | ||
title: '' | ||
labels: '' | ||
assignees: atillack | ||
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**Describe the bug** | ||
A clear and concise description of what the bug is along with relevant output. | ||
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**To Reproduce** | ||
Show us how to reproduce the failure. Please include which options are used (i.e. `--filelist`, `--import_dpf`). If you can, please also share with us the necessary files (receptor and ligand PDBQT files, AutoDock maps or DLG files, etc,..). | ||
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**Expected behavior** | ||
A clear and concise description of what you expected to happen. | ||
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**Information to help narrow down the bug** | ||
- Which version of AutoDock-GPU are you using? | ||
- Which operating system are you on? | ||
- Which compiler, compiler version, and `make` compile options did you use? | ||
- Which GPU(s) are you running on and is Cuda or OpenCL used? | ||
- Which driver version and if applicable, which Cuda version are you using? | ||
- When compiling AutoDock-GPU, are `GPU_INCLUDE_PATH` and `GPU_LIBRARY_PATH` set? Are both environment variables set to the correct directories, i.e. corresponding to the correct Cuda version or OpenCL library? | ||
- Did this bug only show up recently? Which version of AutoDock-GPU, compiler, settings, etc. were you using that worked? |
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name: Feature request | ||
about: Suggest an idea for this project | ||
title: '' | ||
labels: '' | ||
assignees: '' | ||
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**Is your feature request related to a problem? Please describe.** | ||
A clear and concise description of what the problem is. Ex. I'm always frustrated when [...] | ||
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**Describe the solution you'd like** | ||
A clear and concise description of what you want to happen. | ||
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**Describe alternatives you've considered** | ||
A clear and concise description of any alternative solutions or features you've considered. | ||
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**Additional context** | ||
Add any other context or screenshots about the feature request here. |
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name: General Question | ||
about: Ask a general question to get help | ||
title: '' | ||
labels: '' | ||
assignees: '' | ||
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