Ecosyste.ms: Packages
An open API service providing package, version and dependency metadata of many open source software ecosystems and registries.
pypi.org "drug discovery" keyword
macaw-py 1.0.1
MACAW molecular embedder and generator1 version - Latest release: about 2 years ago - 1 dependent repositories - 22 downloads last month - 13 stars on GitHub - 1 maintainer
pysar 2.4.3
A Python package used to analysis Sequence Activity Relationships (SARs) of protein sequences and...35 versions - Latest release: 6 months ago - 1 dependent repositories - 181 downloads last month - 4 stars on GitHub - 1 maintainer
Top 3.7% on pypi.org
18 versions - Latest release: about 1 month ago - 2 dependent packages - 7 dependent repositories - 18 thousand downloads last month - 1,520 stars on GitHub - 3 maintainers
chemprop 2.0.0
Molecular Property Prediction with Message Passing Neural Networks18 versions - Latest release: about 1 month ago - 2 dependent packages - 7 dependent repositories - 18 thousand downloads last month - 1,520 stars on GitHub - 3 maintainers
ops.py 0.1.0a2
Python Library for the Open PHACTS Platform API2 versions - Latest release: almost 10 years ago - 2 dependent repositories - 19 downloads last month - 0 stars on GitHub - 1 maintainer
screenlamp 0.0.1dev0
screenlamp, a toolkit for ligand-based virtual screening1 version - Latest release: 10 months ago - 1 dependent repositories - 1 maintainer
chemspaceal 2.0.1
ChemSpaceAL Python package: an efficient active learning methodology applied to protein-specific ...5 versions - Latest release: 3 months ago - 34 downloads last month - 13 stars on GitHub - 2 maintainers
ringtail 1.1.0
Package for creating database from virtual screening files and performing filtering on results.2 versions - Latest release: 7 months ago - 71 downloads last month - 30 stars on GitHub - 1 maintainer
cando-py 2.3.2
CANDO is a unique computational drug discovery, design, and repurposing platform.3 versions - Latest release: almost 2 years ago - 44 downloads last month - 33 stars on GitHub - 1 maintainer
mdrmf 0.0.6
Multidrug Resistance Machine Fishing6 versions - Latest release: 2 months ago - 59 downloads last month - 0 stars on GitHub - 1 maintainer
aidd-codebase 0.2.0
High-level codebase for deep learning development in drug discovery.13 versions - Latest release: over 1 year ago - 156 downloads last month - 5 stars on GitHub - 2 maintainers
proteingraphml 0.1.1
Knowledge Graphs for Protein Science2 versions - Latest release: over 2 years ago - 1 dependent repositories - 24 downloads last month - 16 stars on GitHub - 1 maintainer
Related Keywords
machine learning
6
machine-learning
3
drug-discovery
3
virtual screening
2
bioinformatics
2
deep learning
2
python
2
drug design
2
docking
2
biomedical informatics
1
computational biology
1
drug repurposing
1
translational bioinformatics
1
autodock
1
molecular modeling
1
molecular generation
1
artificial intelligence
1
cheminformatics
1
modeling and simulation
1
biomedical-informatics
1
drug-design
1
drug-repurposing
1
multitarget
1
shotgun
1
machine fishing
1
pool based active learning
1
aidd
1
deep-learning
1
pytorch-lightning
1
science
1
biology
1
molecular design
1
synthetic biology
1
protein engineering
1
pypi
1
directed evolution
1
sequence activity relationships
1
SAR
1
aaindex
1
protpy
1
protein descriptors
1
cicd
1
research-project
1
sequence-activity-relationships
1
sequence-function-relationships
1
chemistry
1
property prediction
1
message passing neural network
1
graph neural network
1
neural-networks
1
api data integration
1
database
1
ligand-based screening
1
molecular structure
1
active learning
1