 Alexander Rose
|
48c242d59d
fix chain-id coloring for multi-model structures
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
8b4603d5a1
semicolon
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
cc6dce8845
numModels param for first model
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
b2eac8092c
cleanup
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
a22362bac8
hydrogen flag
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
298b283686
revert config
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
14f4de2e3f
revert config
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
9bde4c40b0
enforce first model
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
61390cb64f
group by query
|
%!s(int64=4) %!d(string=hai) anos |
|
Alexander Rose
|
1b67bc41f5
explicit pdbqt provider
|
%!s(int64=4) %!d(string=hai) anos |
|
Alexander Rose
|
5b698b816e
basic partial charge and pdbt support
|
%!s(int64=4) %!d(string=hai) anos |
|
Alexander Rose
|
bf9303ea80
number parser fix, handle prefixed plus sign
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
017676c148
path TODO
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
526f7700b2
cleanup
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
220e01106f
lint
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
240de5b24d
cleanup
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
17a001427b
spelling
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
a423970b9c
basic ligand writing
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
56f4c8775f
cleanup
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
5ed4aa0fae
SdfFile tweaks
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
4f4245b895
sdf def, reader, spec
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
bc6d2112e2
refactoring
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
3b2b87d264
tweaks to sdf output
|
%!s(int64=4) %!d(string=hai) anos |
|
Alexander Rose
|
181646f052
membrane orientation tweaks
|
%!s(int64=4) %!d(string=hai) anos |
|
Alexander Rose
|
ea5a945810
Merge pull request #47 from JonStargaryen/anvil
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
7cfdc8ab1b
lint
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
52e011ade9
wip query mode
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
895e2ede2d
mol2 stub
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
3a25769a94
style
|
%!s(int64=4) %!d(string=hai) anos |
|
JonStargaryen
|
5db4b48a86
putative check for compatible encoding
|
%!s(int64=4) %!d(string=hai) anos |
