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Test stability of serialized representations

Status: Open.

#1181 In openforcefield/openff-interchange;

· mattwthompson opened on Mar 5, 2025

Think about hijacking atom metadata for virtual site bookkeepping

Status: Open.

#1201 In openforcefield/openff-interchange;

· mattwthompson opened on Apr 15, 2025

Should <code>Interchange.minimize</code> also modify topology positions?

interchange-1.0

Status: Open.

#1202 In openforcefield/openff-interchange;

· pbuslaev opened on Apr 16, 2025

Combining SMIRNOFF interchanges with isomorphic molecules with different charges uses only the charges from the latter molecule

bugSomething isn't workingSomething isn't working

Status: Open.

#1075 In openforcefield/openff-interchange;

· Yoshanuikabundi opened on Oct 8, 2024

Improve runtime performance on systems containing biopolymers

polymer-performance

Status: Open.

#1280 In openforcefield/openff-interchange;

· mattwthompson opened on Jul 29, 2025

Improve interoperability testing on systems containing biopolymers

Status: Open.

#1281 In openforcefield/openff-interchange;

· mattwthompson opened on Jul 29, 2025

Make <code>Interchange.topology</code> read-only

Status: Open.

#1282 In openforcefield/openff-interchange;

· mattwthompson opened on Jul 29, 2025

Docs: Document atom ordering in impropers

Status: Open.

#186 In openforcefield/openff-interchange;

· mattwthompson opened on May 17, 2021

[ENH] Packmol interface: allow user set seed?

system preparation

Status: Open.

#1317 In openforcefield/openff-interchange;

· IAlibay opened on Sep 8, 2025

Interchange 1.0

Status: Open.

#1416 In openforcefield/openff-interchange;

· mattwthompson opened on Jun 1, 2025

Improve discoverability within docs

Status: Open.

#1236 In openforcefield/openff-interchange;

· mattwthompson opened on Jun 3, 2025

Consider renaming <code>EnergyReport.compare</code>

Status: Open.

#1284 In openforcefield/openff-interchange;

· mattwthompson opened on Jul 30, 2025

<code>_box_from_density</code> doesn't account for solute mass

feedback neededCould use feedback from usersCould use feedback from users

needs-infoNeeds more information from user(s)Needs more information from user(s)

system preparation

Status: Open.

#1290 In openforcefield/openff-interchange;

· IAlibay opened on Aug 10, 2025

Make Packmol wrapper part of public API

system preparation

Status: Open.

#1170 In openforcefield/openff-interchange;

· mattwthompson opened on Feb 25, 2025