Tag: v0.1.4
Title: fileMover v0.1.4- Enhanced add_rsd Function
New Features
- Initial release of hplctools package
- Added
calculate_gradient_volume()function for calculating HPLC mobile phase volumes- Supports gradient elution programs
- Calculates volumes for multiple samples
- Includes configurable extra volume factor
Function Details
calculate_gradient_volume()
- Input: Gradient program data frame (Time, Flow, B%)
- Parameters:
- sample_number: Number of samples to analyze
- extra_volume: Factor for additional volume (default 1.2)
- Output:
- Detailed calculations
- Single sample volumes
- Total required volumes with extra volume factor
Enhancement
- `calculate_gradient_volume() function now supports
Usage Examples
result <- calculate_gradient_volume(df, sample_number = 10, extra_volume = 1.3)
print(result$all_samples)
print(result$detailed_data)
print(result$single_sample)