Skip to content

Releases: cmelab/polybinder

0.5.1

20 Dec 20:01
@chrisjonesBSU chrisjonesBSU
0.5.1
0d3fbfa
This commit was created on GitHub.com and signed with GitHub’s verified signature. The key has expired.
GPG key ID: 4AEE18F83AFDEB23
Expired
Learn about vigilant mode.
Compare
Choose a tag to compare
0.5.1 Latest
Latest

Changes:

  • PPS molecule added to compound library
  • Improved shrinking procedure that includes temperature annealing
  • Addition of partial charge information to compound library
  • Small fixes to improve performance.
Assets 2
Loading

v0.4.4-hoomd2

14 Apr 20:49
@chrisjonesBSU chrisjonesBSU
0.4.4
79c2447
This commit was created on GitHub.com and signed with GitHub’s verified signature. The key has expired.
GPG key ID: 4AEE18F83AFDEB23
Expired
Learn about vigilant mode.
Compare
Choose a tag to compare
v0.4.4-hoomd2 Pre-release
Pre-release

This release is the latest state of polybinder before the API was changed to be compatible with hoomd3. If you need to run polybinder using hoomd2, use this.

Assets 2
Loading