deepmodeling Uni-Mol issues

deepmodeling / Uni-Mol

Official Repository for the Uni-Mol Series Methods

MIT License

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Yn unimol2

#291 Naplessss closed 15 hours ago
0
Update README.md

#290 Naplessss closed 15 hours ago
0
跑通

#289 Self-333 opened 4 days ago
10
Yn unimol2

#288 emotionor closed 1 day ago
3
How to implement a simple inference?

#287 18930215187 opened 3 weeks ago
2
How to reimplement with other molecular feature

#286 legendzzy opened 3 weeks ago
3
Integrating Uni-Mol2 with unimol_tools

#285 YikunHan42 opened 3 weeks ago
3
DEMO code for extracting features using UNIMOL2

#284 pansanity666 opened 3 weeks ago
1
Update README.md

#283 Letian88 closed 4 weeks ago
0
UniMol2 to fine-tune and inference in the regression(property predict)

#282 chengfengke opened 1 month ago
1
UniMol Docking v2 on PoseBusters quality checks

#281 liyue9129 opened 1 month ago
0
update README

#280 Letian88 closed 1 month ago
0
uni-mol2 codebase

#279 Letian88 closed 1 month ago
0
交叉熵损失

#278 lmqfly opened 1 month ago
0
Retraining Saved Models in a Self-Training Setting

#277 YikunHan42 closed 1 month ago
2
poses in sdf missing end of file and protonation

#276 CLG68 opened 1 month ago
0
Freezing layers for molecule architecture

#275 YikunHan42 closed 2 months ago
2
UNI-Dock2 question

#274 abiotik opened 2 months ago
1
Cannot reproduce the UniMol: Molecular Conformation Generation result

#273 tewiSong closed 2 months ago
8
Uni-Mol2 Code

#272 YikunHan42 closed 2 months ago
2
multi-label classification下split_method如何使用stratified

#271 YikunHan42 closed 2 months ago
4
口袋模型预训练时用到的是哪种pocket pdb？

#270 ai4protein opened 2 months ago
1
用unimol+模型 inference出的pos_pred取同一个id的均值吗？

#269 chenkk717 opened 2 months ago
8
update pypi description using readme

#268 emotionor closed 2 months ago
0
fix: Ensure tense uniformity in log messages

#267 zt10001 closed 2 months ago
1
update gen comformer log from fail to succeed

#266 emotionor closed 2 months ago
0
Trying Uni-Mol tools tutorial on molecule and atoms level representation: Failed to generate (3D) conformers

#265 zt10001 closed 2 months ago
2
Notebook cmd missing arg

#264 hypnopump closed 2 months ago
0
Problem reproducing molecule conformation generation results using UniMol

#263 oopstom closed 2 months ago
4
Uni-Mol numpy version

#262 favor2021 opened 2 months ago
3
Unimol Docking V2 strange result on posebuster set

#261 simmed00 opened 2 months ago
5
Update README.md

#260 Naplessss closed 2 months ago
0
Question Regarding Data Preprocessing for train.lmdb and valid.lmdb from MOAD in docking_v2 Directory

#259 iceissey opened 3 months ago
1
Update README.md

#258 Naplessss closed 3 months ago
0
Do you use cpu only for Inference in uni-mol dockingv2

#257 min0210 closed 3 months ago
2
demo.sh doesn't make pkl file

#256 min0210 opened 3 months ago
2
Unrecognized atom type

#255 CLG68 opened 3 months ago
9
Refine weight path

#254 emotionor closed 4 months ago
0
repalce Uni-Core address

#253 Letian88 closed 4 months ago
0
replace Uni-Core address

#252 Letian88 closed 4 months ago
0
Update requirements.txt

#251 Letian88 closed 4 months ago
0
Update README.md

#250 HongshuaiWang1 closed 4 months ago
0
fix optional import and typo

#249 ZhouGengmo closed 4 months ago
0
docking.py error

#248 Golden-proteogenomics opened 4 months ago
3
add atom repr;use mean repr in notebook

#247 ZhouGengmo closed 4 months ago
0
replace github address

#246 Letian88 closed 4 months ago
0
Update README.md

#245 Letian88 closed 4 months ago
0
Docs update

#244 emotionor closed 4 months ago
0
update docs

#243 emotionor closed 4 months ago
0
unimpl_tools issue about “molecule property prediction”

#242 Golden-proteogenomics opened 4 months ago
8