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Commits on Jul 1, 2022

• fixes

  dkoes

  committed
  71cf2cc

Commits on Jul 2, 2021

• Fix py3 bug

  dkoes

  committed
  bd54584

Commits on Nov 9, 2020

• recligmin

  dkoes

  committed
  2aa2a60

Commits on Feb 7, 2020

• Merge branch 'master' of github.com:dkoes/rdkit-scripts

  dkoes

  committed
  397fe22

• alignmcs

  dkoes

  committed
  a5037fe

Commits on Apr 15, 2019

• Merge pull request #1 from francoep/patch-1

  Show description for e2b22aa
  dkoes

  authored
  e2b22aa

• Update uffminimize.py

  Show description for 2c3587c
  francoep

  authored
  2c3587c

Commits on Jun 1, 2018

• change default deg

  dkoes

  committed
  e264f32

• rm debug info, keep hydrogens because otherwise problems

  dkoes

  committed
  770821c

• exhaustive conformer genration

  dkoes

  committed
  bd8111e

• Merge branch 'master' of github.com:dkoes/rdkit-scripts

  dkoes

  committed
  84c012b

• rdallconf

  dkoes

  committed
  b27ea73

Commits on May 14, 2017

• bf nomin

  dkoes

  committed
  ea82e84

Commits on May 9, 2017

• bf

  dkoes

  committed
  53ff0ec

Commits on May 5, 2017

• bugfix

  dkoes

  committed
  bb6668d

• edits for evaluating alt generators

  dkoes

  committed
  8118fd3

Commits on Oct 27, 2016

• more info

  dkoes

  committed
  fab43da

• better intro comment

  dkoes

  committed
  c1996bd

• useful(?) scripts that use rdkit

  dkoes

  committed
  b580b64

• Initial commit

  dkoes

  committed
  bb9b91e