pypi.org "ligand" keyword
View the packages on the pypi.org package registry that are tagged with the "ligand" keyword.
docksuitex 2.0.2
All-in-one protein-ligand docking package for Windows with bundled tools4 versions - Latest release: about 16 hours ago - 445 downloads last month - 0 stars on GitHub - 1 maintainer
Top 8.8% on pypi.org
2 versions - Latest release: over 1 year ago - 4 dependent repositories - 460 downloads last month - 187 stars on GitHub - 1 maintainer
gauche 0.1.6
Gaussian Process Library for Molecules, Chemical Reactions and Proteins.2 versions - Latest release: over 1 year ago - 4 dependent repositories - 460 downloads last month - 187 stars on GitHub - 1 maintainer
pdbeccdutils 1.0.0
Toolkit to parse and process small molecules in wwPDB18 versions - Latest release: 3 days ago - 1 dependent repositories - 8.15 thousand downloads last month - 67 stars on GitHub - 1 maintainer
pdbe-arpeggio 1.4.4
Arpeggio calculates interatomic contacts based on the rules defined in CREDO.2 versions - Latest release: over 1 year ago - 3.13 thousand downloads last month - 77 stars on GitHub - 1 maintainer
entrain-spatial 0.0.1
A single-cell analysis package to elucidate environmental factors controlling cell differentiatio...1 version - Latest release: about 2 years ago - 10 downloads last month - 1 maintainer
claffinity 1.0.2
A tool for investigating the impact of labelled ligand affinity in competition experiments.2 versions - Latest release: over 3 years ago - 1 dependent repositories - 14 downloads last month - 2 stars on GitHub - 1 maintainer
dockstring 0.3.4
Package for easy ligand preparation and docking with AutoDock Vina against a highly-curated selec...3 versions - Latest release: 11 months ago - 523 downloads last month - 173 stars on GitHub - 1 maintainer
Top 6.4% on pypi.org
13 versions - Latest release: 2 months ago - 8 dependent packages - 7 dependent repositories - 21.2 thousand downloads last month - 45 stars on GitHub - 2 maintainers
omnipath 1.0.12
Python client for the OmniPath web service13 versions - Latest release: 2 months ago - 8 dependent packages - 7 dependent repositories - 21.2 thousand downloads last month - 45 stars on GitHub - 2 maintainers
pycaverdock 1.2.0
Python API for CaverDock2 versions - Latest release: over 2 years ago - 1 dependent repositories - 22 downloads last month - 1 maintainer
pandamap-color 2.0.0
Versatile visualization tool for protein-ligand interactions with customizable color schemes3 versions - Latest release: 5 months ago - 31 downloads last month - 5 stars on GitHub - 1 maintainer
entrain 0.0.79
A single-cell analysis package to elucidate environmental factors controlling cell differentiatio...16 versions - Latest release: almost 2 years ago - 92 downloads last month - 1 maintainer
pdberellig 1.0.0
A toolkit for functional annotation of ligands in the PDB1 version - Latest release: 10 months ago - 11 downloads last month - 7 stars on GitHub - 1 maintainer
pbcnet 2.0.9
PBCNet: Deep learning framework for protein-ligand binding affinity prediction2 versions - Latest release: 2 months ago - 1 maintainer
Related Keywords
protein
8
bioinformatics
5
receptor
3
PDB
3
docking
3
drug discovery
2
RNA
2
differentiation
2
single cell
2
velocity
2
TRRD
1
TopDB
1
UniProt
1
Vesiclepedia
1
activity flow
1
adhesion
1
gene symbol
1
annotations
1
cancer
1
complexes
1
dephosphorylation
1
directed graph
1
disease
1
gene
1
autodock
1
NCI-PID
1
NRF2ome
1
NetPath
1
ORegAnno
1
PANTHER
1
PAZAR
1
PPI
1
Phobius
1
Phosphatome
1
PhosphoPoint
1
PhosphoSite
1
Reactome
1
SIGNOR
1
SPIKE
1
STRING
1
SignaLink
1
Surfaceome
1
TRED
1
subcellular localization
1
transcription
1
transporter
1
CaverDock
1
tunnel
1
visualization
1
structural biology
1
color schemes
1
drug design
1
molecular interactions
1
cofactor
1
reactant
1
drug
1
annotation
1
deep learning
1
binding affinity
1
iTALK
1
integrin
1
intercellular communication
1
ion channel
1
kinase
1
mRNA
1
miRNA
1
mouse
1
pathway
1
phosphatase
1
phospho.ELM
1
phosphorylation
1
rat
1
regulation
1
signaling
1
signaling pathway
1
CREDO
1
atomic-interactions
1
cheminformatics
1
structural-bioinformatics
1
competition
1
label
1
binding
1
benchmark
1
ARN
1
Autophagy
1
BioGRID
1
BioPAX
1
CORUM
1
COSMIC
1
CPAD
1
Cancer Gene Census
1
vina
1
machine-learning
1
gaussian-processes
1
kernels
1
pytorch
1
chemistry
1
biology
1
small molecule
1
complex
1