Support

Documentation and updates are published at dropps.online.

Report reproducible software defects through the DROPPS issue tracker. Scientific or project-specific questions can be directed to ymtang@fudan.edu.cn.

Before opening an issue

Include:

  • dps --version and python --version;

  • the OpenMM version and selected compute platform;

  • the complete command and error text;

  • DROPPS_DEBUG=1 traceback when relevant;

  • a minimal, non-sensitive input that reproduces the problem; and

  • whether the problem persists in a clean environment.

Do not upload confidential or restricted research data. Replace it with a small synthetic reproducer whenever possible.

Command discovery

Use these local references before filing an interface question:

dps help commands
dps <command> -h

The complete generated reference is available at Command reference.