Shyue Ping Ong
shyuep
Professor in Materials Science and Engineering at the National University of Singapore. Materials informatics pioneer.
Materials Virtual Lab Singapore
Aron Walsh
aronwalsh
Chief Scientific Officer @Cusp-AI | Professor @ImperialCollegeLondon
@WMD-group
Meta
facebook
We are working to build community through open source technology. NB: members must have two-factor auth.
Menlo Park, California
Open Force Field Initiative
openforcefield
An open source, open science, and open data approach to better force fields
mongodb-js
mongodb-js is a collective of JavaScript developers and code focused on interacting with MongoDB
XtalOpt
xtalopt
An open-source multi-objective evolutionary algorithm for variable-composition crystal structure prediction
DFT-D3
dftd3
Consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D)
Benjamin Morgan
bjmorgan
Computational Chemistry at the University of Bath, UK.
University of Bath Bath, UK
Wassim Tenachi
WassimTenachi
Postdoctoral Fellow in Astrophysics x ML @ MILA / Université de Montréal
MILA Montréal
Leverhulme Research Centre for Functional Materials Design
lrcfmd
Code hosted here has been developed by researchers working with the LRC, hosted at the University of Liverpool
Glotzer Group
glotzerlab
We develop molecular simulation tools to study the self-assembly of complex materials and explore matter at the nanoscale.
University of Michigan
MDAnalysis
MDAnalysis
working with data in the computational molecular sciences
United States of America
PreviousNext