A curated list of Python packages related to chemistry
created at Jan. 30, 2017, 9:10 a.m.
56 +0
1,040 +6
201 +1
An open library for the analysis of molecular dynamics trajectories
created at Nov. 8, 2012, 10:01 p.m.
48 +0
557 +1
270 +0
A list of deep learning implementations in biology
created at June 1, 2016, 8:44 p.m.
230 +0
1,961 +1
471 -1
Message Passing Neural Networks for Molecule Property Prediction
created at Jan. 25, 2019, 11:33 p.m.
37 +0
1,583 +6
547 +3
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
created at Sept. 24, 2015, 11:20 p.m.
148 +1
5,187 +14
1,625 +1