Code

Merging tmqm branch#33

Code

Merged

FNTwin merged 11 commits intomainvalence-labs/OpenQDC:mainfrom tmqm_addvalence-labs/OpenQDC:tmqm_addCopy head branch name to clipboardFeb 9, 2024

+615-115

Commits

Commits on Dec 5, 2023

• Ad hoc en for tmqm

  FNTwin

  committed
  3ed6089

Commits on Dec 7, 2023

• Added atoms_per_molecules, unit transition1x, fixed dummy class

  

  FNTwin

  committed
  87db734

Commits on Jan 15, 2024

• Updated dummy dataset

  

  Nikhil Shenoy

  committed
  61bb40c

Commits on Jan 19, 2024

• Merge pull request #32 from OpenDrugDiscovery/dummy-fix-tmqm

  Show description for 5eb76e0
  prtos

  authored
  5eb76e0

Commits on Jan 21, 2024

• Update gcp path

  prtos

  authored
  14d3e85

Commits on Jan 22, 2024

• removed torch-dependency

  shenoynikhil

  committed
  feb3671

Commits on Jan 24, 2024

• New normalization energy + Fixes + Merge

  

  FNTwin

  committed
  2b88e10

• Merge remote-tracking branch 'origin/remove-torch-dependency' into tmqm_add

  

  FNTwin

  committed
  7d0f6c1

Commits on Jan 31, 2024

• Updated filesystem and remote_cache for public download

  FNTwin

  committed
  b5705ce

Commits on Feb 6, 2024

• Fix writing and reading, spice read + pcqm init, os.environ

  

  FNTwin

  committed
  6d2500f

• Merge branch 'tmqm_add' of https://github.com/OpenDrugDiscovery/openQDC into tmqm_add

  

  FNTwin

  committed
  a356603