mirror of
https://github.com/K-Dense-AI/claude-scientific-skills.git
synced 2026-01-26 16:58:56 +08:00
Updated installation instructions for all skills to always use uv pip install
This commit is contained in:
@@ -17,10 +17,10 @@ Install gget in a clean virtual environment to avoid conflicts:
|
||||
|
||||
```bash
|
||||
# Using uv (recommended)
|
||||
uv pip install gget
|
||||
uv uv pip install gget
|
||||
|
||||
# Or using pip
|
||||
pip install --upgrade gget
|
||||
uv pip install --upgrade gget
|
||||
|
||||
# In Python/Jupyter
|
||||
import gget
|
||||
@@ -302,13 +302,8 @@ Predict 3D protein structures using simplified AlphaFold2.
|
||||
|
||||
**Setup Required**:
|
||||
```bash
|
||||
# Install OpenMM first (version depends on Python version)
|
||||
# Python < 3.10:
|
||||
conda install -qy conda==4.13.0 && conda install -qy -c conda-forge openmm=7.5.1
|
||||
# Python 3.10:
|
||||
conda install -qy conda==24.1.2 && conda install -qy -c conda-forge openmm=7.7.0
|
||||
# Python 3.11:
|
||||
conda install -qy conda==24.11.1 && conda install -qy -c conda-forge openmm=8.0.0
|
||||
# Install OpenMM first
|
||||
uv pip install openmm
|
||||
|
||||
# Then setup AlphaFold
|
||||
gget setup alphafold
|
||||
@@ -835,7 +830,7 @@ gget ref -w dna -d homo_sapiens
|
||||
- Check PDB database first before running AlphaFold predictions
|
||||
|
||||
### Error Handling
|
||||
- Database structures change; update gget regularly: `pip install --upgrade gget`
|
||||
- Database structures change; update gget regularly: `uv pip install --upgrade gget`
|
||||
- Process max ~1000 Ensembl IDs at once with gget info
|
||||
- For large-scale analyses, implement rate limiting for API queries
|
||||
- Use virtual environments to avoid dependency conflicts
|
||||
|
||||
Reference in New Issue
Block a user