benb111/awesome-small-molecule-ml

A curated list of resources for machine learning for small-molecule drug discovery

Size: 102 KB - Last synced: 2 days ago - Pushed: 6 months ago - Stars: 176 - Forks: 27

benb111/outlier-detect

Code that implements the novel outlier detection algorithms from my Ph.D. dissertation.

Language: Python - Size: 63.5 KB - Last synced: about 1 year ago - Pushed: over 2 years ago - Stars: 20 - Forks: 22

benb111/awesome-python-chemistry Fork of lmmentel/awesome-python-chemistry

A curated list of Python packages related to chemistry

Size: 176 KB - Last synced: about 1 year ago - Pushed: over 2 years ago - Stars: 1 - Forks: 1

benb111/TDC Fork of mims-harvard/TDC

Therapeutics Data Commons: Machine Learning Datasets and Tasks for Drug Discovery and Development

Language: Jupyter Notebook - Size: 63.1 MB - Last synced: about 1 year ago - Pushed: over 2 years ago - Stars: 0 - Forks: 0

benb111/awesome-cheminformatics Fork of hsiaoyi0504/awesome-cheminformatics

A curated list of Cheminformatics libraries and software.

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benb111/unet

Language: Jupyter Notebook - Size: 7.7 MB - Last synced: about 1 year ago - Pushed: almost 3 years ago - Stars: 0 - Forks: 0

benb111/pipekit-ml01

Language: Python - Size: 3.91 KB - Last synced: about 1 year ago - Pushed: over 3 years ago - Stars: 0 - Forks: 1

benb111/pipekit

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benb111/environment-scripts

Scripts and config files for my Mac OS X development environment

Language: Shell - Size: 105 KB - Last synced: about 1 year ago - Pushed: over 11 years ago - Stars: 0 - Forks: 0