Skip to content

Instantly share code, notes, and snippets.

View leelasd's full-sized avatar
🏠
Working from home

Leela S. Dodda leelasd

🏠
Working from home
View GitHub Profile
@leelasd
leelasd / hydrophobic_moment.py
Created September 30, 2020 18:26 — forked from JoaoRodrigues/hydrophobic_moment.md
Peptide/Protein Hydrophobic Moment Calculator
#!/usr/bin/env python
"""
Calculates a set of properties from a protein sequence:
- hydrophobicity (according to a particular scale)
- mean hydrophobic dipole moment assuming it is an alpha-helix.
- total charge (at pH 7.4)
- amino acid composition
- discimination factor according to Rob Keller (IJMS, 2011)
@leelasd
leelasd / 3D-MCS.ipynb
Created October 27, 2020 22:51 — forked from greglandrum/3D-MCS.ipynb
3D-MCS.ipynb
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
@leelasd
leelasd / SAR Tables.ipynb
Created October 27, 2020 22:51 — forked from greglandrum/SAR Tables.ipynb
SAR Tables.ipynb
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
@leelasd
leelasd / Schmidtke_ReversingReactions.ipynb
Created October 27, 2020 22:52 — forked from greglandrum/Schmidtke_ReversingReactions.ipynb
Schmidtke_ReversingReactions.ipynb
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
@leelasd
leelasd / Taka_ConstrainedEmbedding.ipynb
Created October 27, 2020 22:54 — forked from greglandrum/Taka_ConstrainedEmbedding.ipynb
Taka_ConstrainedEmbedding.ipynb
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
@leelasd
leelasd / KNIME_from_Jupyter_demo.ipynb
Created October 27, 2020 22:55 — forked from greglandrum/KNIME_from_Jupyter_demo.ipynb
KNIME from Jupyter_demo.ipynb
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
@leelasd
leelasd / Show_Ph4_Features_in_PyMOL.ipynb
Created October 27, 2020 22:56 — forked from greglandrum/Show_Ph4_Features_in_PyMOL.ipynb
Show_Ph4_Features_in_PyMOL.ipynb
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
@leelasd
leelasd / Clustering Methods.ipynb
Created October 27, 2020 22:59 — forked from greglandrum/Clustering Methods.ipynb
Clustering Methods.ipynb
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.