Denis Sapegin's repositories
PyVaporation
The solution for modelling pervaporation membrane performance based on experimental data
Bassa
Automated Download Queue for Communities to take the best use of Internet bandwidth
Language:JavaScriptGPL-3.0000
cite
Command line tool to get bibliography e.g. BibTex entries
Language:PythonBSD-2-Clause000
Mole-BERT
[ICLR 2023] "Mole-BERT: Rethinking Pre-training Graph Neural Networks for Molecules"
Language:Python000
pytz
pytz Python historical timezone library and database
Language:CMIT000
structure-seer
The implementation, training and evaluation of a Structure Seer machine learning model designed for reconstruction of adjacency of a molecular graph from the labelling of its nodes.
Language:PythonApache-2.0000