Issues

• cremdock_plif

  ci-lab-cz/crem-dock#71 · Filter by author DrrDom opened on Aug 9, 2025
  2

• Guidance on Using CReM Dock for Multi-Site Molecule Design

  ci-lab-cz/crem-dock#67 · Filter by author 28vipraparekh opened on Mar 7, 2025
  7

• rdkit kekulization problem during tautomerization by cxcalc

  ci-lab-cz/crem-dock#49 · Filter by author GuzelMinibaeva opened on Jun 16, 2023

• plif.py does not work if ncpu is greater than number of input mols

  ci-lab-cz/crem-dock#43 · Filter by author DrrDom opened on Aug 24, 2022

• Implement a single config file

  ci-lab-cz/crem-dock#24 · Filter by author DrrDom opened on Nov 4, 2021

• Random seed

  ci-lab-cz/crem-dock#17 · Filter by author DrrDom opened on Sep 1, 2021