ligands

There are 0 repository under ligands topic.

arc85 / celltalker
Inference of cell-cell communication from single-cell RNAseq data
ligands receptors single-cell transcriptomics
Language:R 44
lucagl / MOAD_ligandFinder
A script able to extract ligands from pdb structure(s) and remove them from the original structure. The ligands are identified according to the *valid* ligands found in the binding MOAD database. The ligand can be extracted as a pdb or as a xyz (coordinate) file. Other options such as converting the queried pdb to pqr are available .
pdb-files ligands pqr-files binding-moad extract-ligand remove-ligands
Language:Python 13
digital-chemistry-laboratory / libconeangle
Library for calculating exact ligand cone angles
quantum-chemistry ligands molecular-features
Language:Fortran 10
jkarolczak / ligand-classification
Project examing sparse deep learning architectures for ligand classification.
deep-learning machine-learning classification sparsity minkowski-engine ligand
Language:Jupyter Notebook 3
Rimmavane / CHEMBL_VS_dataset
Multi-step pipeline that provides tools for filtering ChEMBL protein target using both physical and chemical features. This project was created in terms of my masters thesis which can be read here: https://www.overleaf.com/read/kwmnwnrwkntb
blast decoys ligands
Language:Python 1
JMacnar / ring_analysis
Easy to use analysis of six-membered ring in ligands present in prtoein complexes.
ligands protein-structure reproducibility
Language:Jupyter Notebook

arc85 / celltalker