Issues

• User-defined colvarsRestartFrequency may create incompatibilities with timeStepFactor

  bug
  Colvars/colvars#957 · Filter by author giacomofiorin opened on Sep 10, 2026

• OpenMM-Colvars Interface

  Colvars/colvars#950 · Filter by author fhh2626 opened on Jul 30, 2026
  6

• Where is the useHillsReflection keyword?

  Colvars/colvars#935 · Filter by author fhh2626 opened on Jun 2, 2026
  2

• Child class of colvarproxy with custom close_output_stream cannot be safely deleted

  bug
  Colvars/colvars#930 · Filter by author HanatoK opened on Apr 27, 2026

• Updating VMD 1.9.4 and VMD 2 separately?

  VMD
  Colvars/colvars#921 · Filter by author giacomofiorin opened on Feb 17, 2026
  3

• Huge CPU performance loss when using cvm::position_distance

  optimization
  Colvars/colvars#911 · Filter by author HanatoK opened on Jan 28, 2026
  6

• Convert containers to Docker format for CI jobs

  maintenance
  Colvars/colvars#910 · Filter by author giacomofiorin opened on Jan 22, 2026

• Coverity: Incorrect expression (UNINTENDED_INTEGER_DIVISION)

  bug
  Colvars/colvars#907 · Filter by author jhenin opened on Jan 18, 2026

• Make extendedLagrangian and ABF work with vector CVs

  Colvars/colvars#876 · Filter by author jhenin opened on Nov 4, 2025
  

• Simplify colvargrid derived classes

  maintenance
  Colvars/colvars#870 · Filter by author jhenin opened on Oct 20, 2025
  1

• Phase out "enableFitGradients no" from the configuration file

  Colvars/colvars#850 · Filter by author HanatoK opened on Sep 1, 2025
  1

• Too many backup files in GROMACS when colvarsRestartFrequency is small

  documentationGROMACS
  Colvars/colvars#846 · Filter by author HanatoK opened on Aug 28, 2025
  10

  

• Complete gradient tests for all CVCs

  Colvars/colvars#836 · Filter by author jhenin opened on Aug 21, 2025
  3

• Non-reproducible PMF Output from Colvars Poisson Integrator

  Colvars/colvars#823 · Filter by author fhh2626 opened on Jul 30, 2025
  4

• Comparable Colvars version

  Colvars/colvars#809 · Filter by author HanatoK opened on Jun 10, 2025
  5

• Better error message for missing Lepton in subColvar

  Colvars/colvars#807 · Filter by author jhenin opened on May 31, 2025
  2

• smp inner_loop mode is not documented

  documentation
  Colvars/colvars#806 · Filter by author jhenin opened on May 31, 2025
  4

• Crashing while adding a new hill in multiple walkers metadynamics - GROMACS

  bugGROMACS
  Colvars/colvars#804 · Filter by author savenkom opened on May 21, 2025
  6

  

• Feature request: A colvar to track the SASA of a group of atoms.

  Colvars/colvars#790 · Filter by author norman-geist opened on Apr 16, 2025
  3

• GPUresident is not working with bias-exchange metadynamics due to "run norepeat" in NAMD

  Colvars/colvars#772 · Filter by author fabsugar opened on Feb 25, 2025
  3

• issue with pmf printing in bias-exhange metadynamics with NAMD

  Colvars/colvars#771 · Filter by author fabsugar opened on Feb 25, 2025
  2

• Documentation bug: replacements for deprecated keywords can be hard to find

  Colvars/colvars#762 · Filter by author EzryStIago opened on Jan 17, 2025
  1

• Encode LAMMPS version as a string to use in Colvars doc URLs

  documentation
  Colvars/colvars#754 · Filter by author giacomofiorin opened on Dec 3, 2024

• Documentation: update the descriptions of moving frame of reference and enableFitGradients

  Colvars/colvars#748 · Filter by author HanatoK opened on Nov 7, 2024

• Separate computation and update steps into two distinct functions of the module's external API

  Colvars/colvars#747 · Filter by author giacomofiorin opened on Oct 31, 2024
  1