Ecosyste.ms: Issues
An open API service for providing issue and pull request metadata for open source projects.
GitHub / alanwilter/acpype issues and pull requests
#26 - Set atom/bond type judge option
Issue -
State: open - Opened by mquevill over 3 years ago
- 1 comment
#25 - Adding atoms on top of existing atoms
Issue -
State: closed - Opened by mquevill over 3 years ago
- 3 comments
#24 - Some errors in the resulting topologies after conversion to gmx
Issue -
State: open - Opened by kaplajon over 3 years ago
- 5 comments
#23 - Separation of non-water solvent in the topology file.
Issue -
State: closed - Opened by riquri over 3 years ago
- 3 comments
#22 - Atomtype IP not found
Issue -
State: closed - Opened by dvdvbrn over 3 years ago
- 2 comments
#21 - missing dihedral param in CNS params for cyclopropyl
Issue -
State: closed - Opened by mieczyslaw about 4 years ago
- 2 comments
#20 - Fixing citation encoding. More pythonic way of printing.
Pull Request -
State: closed - Opened by ijpulidos about 4 years ago
#19 - Can't encode character in citation
Issue -
State: closed - Opened by ijpulidos about 4 years ago
- 1 comment
#18 - Fixed #17, Black and Flake8 applied
Pull Request -
State: closed - Opened by alanwilter about 4 years ago
#17 - Tutorial needs update
Issue -
State: closed - Opened by germanbarcenas about 4 years ago
- 1 comment
#16 - Acpype lib
Pull Request -
State: closed - Opened by alanwilter over 4 years ago
#15 - Problem generating prm and itp
Issue -
State: closed - Opened by georopon over 4 years ago
- 1 comment
#14 - Not able to generate charmm output
Issue -
State: closed - Opened by bhargavchava97 over 4 years ago
- 4 comments
#13 - Update nonuniform 1-4 charge scaling to use qConv
Pull Request -
State: closed - Opened by austenb28 over 4 years ago
#12 - Value of qConv in acpype.py is too precise compared with that in AmberTools
Issue -
State: closed - Opened by lazaroid over 4 years ago
- 2 comments
#11 - Replace babel command with obabel
Pull Request -
State: closed - Opened by simonbray almost 5 years ago
- 1 comment
#10 - OpenBabel 3 compatibility?
Issue -
State: closed - Opened by simonbray almost 5 years ago
- 6 comments
#9 - Commit tag on new releases
Issue -
State: closed - Opened by simonbray over 5 years ago
- 4 comments
#8 - Error atom type IP
Issue -
State: closed - Opened by amrhamedp over 5 years ago
- 2 comments
#7 - ACPYPE fails with "Substring not found" error
Issue -
State: closed - Opened by sukritsingh over 5 years ago
- 4 comments
#6 - Change shebang line for python3
Pull Request -
State: closed - Opened by lkagami almost 6 years ago
#5 - Update and rename README.txt to README.md
Pull Request -
State: closed - Opened by lkagami about 6 years ago
#4 - Description of Topology_14.p7_array_read
Pull Request -
State: closed - Opened by austenb28 over 6 years ago
#3 - Celery beat - Deleted_by_time
Pull Request -
State: closed - Opened by lkagami over 6 years ago
#2 - tooltips no hard code
Pull Request -
State: closed - Opened by lkagami over 6 years ago
#1 - tooltips no hard code
Pull Request -
State: closed - Opened by lkagami over 6 years ago