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feat: new benchmark water radial distribution

new benchmarkProposals and suggestions for new benchmarksProposals and suggestions for new benchmarks

Status: Open.

#643 In ddmms/ml-peg;

· lwehrhan opened on Jun 24, 2026

feat: new benchmark torsion net 500 dihedral scan

new benchmarkProposals and suggestions for new benchmarksProposals and suggestions for new benchmarks

Status: Open.

#642 In ddmms/ml-peg;

· lwehrhan opened on Jun 24, 2026

feat: new benchmark tautobase reaction energies

new benchmarkProposals and suggestions for new benchmarksProposals and suggestions for new benchmarks

Status: Open.

#641 In ddmms/ml-peg;

· lwehrhan opened on Jun 24, 2026

feat: new benchmark testing molecular dynamics stability of organic molecules and peptides

new benchmarkProposals and suggestions for new benchmarksProposals and suggestions for new benchmarks

Status: Open.

#640 In ddmms/ml-peg;

· lwehrhan opened on Jun 24, 2026

Add partial filtering

enhancementNew feature or requestNew feature or request

Status: Open.

#623 In ddmms/ml-peg;

· ElliottKasoar opened on Jun 18, 2026

Filtering enhancement: add model dataset union and intersections

enhancementNew feature or requestNew feature or request

Status: Open.

#620 In ddmms/ml-peg;

· joehart2001 opened on Jun 16, 2026

Update metals EoS colour scheme

enhancementNew feature or requestNew feature or request

Status: Open.

#568 In ddmms/ml-peg;

· ElliottKasoar opened on May 25, 2026

Model speed benchmarking

new benchmarkProposals and suggestions for new benchmarksProposals and suggestions for new benchmarks

Status: Open.

#557 In ddmms/ml-peg;

· joehart2001 opened on May 18, 2026

Model evaluation on small clusters

new benchmarkProposals and suggestions for new benchmarksProposals and suggestions for new benchmarks

Status: Open.

#546 In ddmms/ml-peg;

· frostedoyster opened on May 12, 2026

small medium and large test variants for long MD tests

enhancementNew feature or requestNew feature or request

Status: Open.

#544 In ddmms/ml-peg;

· joehart2001 opened on May 11, 2026

Draft: Polymer Simulation Benchmark

new benchmarkProposals and suggestions for new benchmarksProposals and suggestions for new benchmarks

Status: Open.

#538 In ddmms/ml-peg;

· gncs opened on May 8, 2026

Replace deprecated Dash DataTable

enhancementNew feature or requestNew feature or request

Status: Open.

#510 In ddmms/ml-peg;

· ElliottKasoar opened on Apr 28, 2026