nczub / SerotoninAI_streamlitLinks
App for serotonergic targets
☆12Updated last week
Alternatives and similar repositories for SerotoninAI_streamlit
Users that are interested in SerotoninAI_streamlit are comparing it to the libraries listed below
Sorting:
- ☆13Updated 6 months ago
- Data repository for pkasolver☆13Updated 3 years ago
- ☆14Updated 3 years ago
- Paper for release☆11Updated 4 years ago
- A PyMOL plugin with accompanying Docker image for kinase inhibitor binding and affinity prediction☆12Updated last year
- KDS software for Kinase Drug Selectivity☆11Updated 2 years ago
- ☆13Updated last year
- ☆13Updated 4 years ago
- Snippets for common computer-aided drug design tasks☆10Updated 8 years ago
- MD DaVis: A python package to analyze molecular dynamics trajectories of proteins☆17Updated 11 months ago
- ☆11Updated 5 years ago
- EvolveX, a de novo antibody computational design pipeline.☆15Updated 3 months ago
- Flexible Artificial Intelligence Docking☆17Updated 4 months ago
- Robust and stable clustering of molecular dynamics simulation trajectories.☆19Updated 3 years ago
- Computational Analysis of Novel Drug Opportunities☆40Updated last week
- Biological Relationships - Biorels data preparation infrastructure for biology and drug discovery☆14Updated 7 months ago
- Target prediction☆13Updated 5 years ago
- Houses deployable code for the SCORCH scoring function and docking pipeline from the related publication: https://doi.org/10.1016/j.jare.…☆18Updated 3 years ago
- This repository provides an implementation of the DTi2Vec tool, to identify Drug-Target interaction using network embedding and ensemble …☆12Updated 4 years ago
- FASTDock: A Pipeline for Allosteric Drug Discovery - example scripts and jupyter notebook☆18Updated 2 years ago
- ☆14Updated 2 years ago
- MEGADOCK on Google Colaboratory☆20Updated 2 years ago
- ☆17Updated 3 years ago
- Automatic extraction of interacting compound-target pairs from ChEMBL.☆21Updated 3 months ago
- Peptide Virtual Screening Pipeline☆12Updated 6 years ago
- ChEMBL Database used to create Lipinski Descriptors (ADME Pharmokinetic Profile) to use in a Random Forest Regression Model☆14Updated 5 years ago
- a protein descriptor for site prediction☆16Updated 6 years ago
- Tools and routines to calculate distances between synthesis routes and to cluster them.☆28Updated 9 months ago
- Improved Scaffold Hopping in Ligand-based Virtual Screening Using Neural Representation Learning☆21Updated 4 years ago
- Drug-Likeness☆16Updated 3 years ago