 Alexander Rose
|
d1bbe015ad
added some mol-io helper methods
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
2446334b41
export schema database as type instead of interface
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
ac614ebd32
updated mmcif: reordered, added chem_comp, entry, struct, struct_keywords
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
ab404049a4
doc
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
e9b57bb89b
improved schema generation from mmcif dic
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
75e1dac484
mmcif, ccd & bird schema updates
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
151ef5d806
vscode
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
00d1e1c555
improving & testing list column type
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
3add0d0636
add tensor handling to cif encoder
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
13e63cedf4
added 'list' column type
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
c73f68023f
added CCD schema
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
4c74909619
add gro format import support to mol-model
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
9184dfafbc
typo
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
c9eba240bb
use const
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
75cc576932
added on-demand file loading to structure perf-test
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
9f2cb62cb6
removed unused file
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
a8f665916d
force int type for some mmcif fields
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
c36c3f0d13
added code generated mmcif schema based on popular fields
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
6629c0b512
improved schema generation and moved to apps folder
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
66f6c54c43
updated readme and packages
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
b64faed5d5
fixed mol2 parser
|
%!s(int64=7) %!d(string=hai) anos |
|
David Sehnal
|
b2c1012c98
Fixed Table.columnToArray
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
923404c20e
wip, fixing mol2 parser (multi model still broken)
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
86b1643af0
fixed ts typecheck
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
0599057716
tweaked moduleNameMapper
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
477f9b6572
try moduleNameMapper for jest
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
81f6ec7b79
tweaked paths in package.json
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
078c9cf2e5
updated packages
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
6eef49d85f
added travis ci config
|
%!s(int64=7) %!d(string=hai) anos |
|
Alexander Rose
|
0b95406cc9
wip, fixing mol2 parser and tests
|
%!s(int64=7) %!d(string=hai) anos |
