thomas0809/MolScribe issues and pull requests

#31 - bond angle(?) issue

Issue - State: closed - Opened by sistar2020 26 days ago - 2 comments

#30 - Problem with color-highlighted image

Issue - State: open - Opened by sistar2020 27 days ago - 2 comments

#29 - Dependency versions

Issue - State: open - Opened by supersciencegrl 3 months ago

#28 - Some question about failure in recognization

Issue - State: open - Opened by sunyrain 3 months ago

#27 - How to generate Synthetic data using ChemDraw? & How to randomly change bond length using Indigo?

Issue - State: closed - Opened by yyaaa1 3 months ago - 4 comments

#26 - Options for Not Expanding Abbreviated Structures During Prediction

Issue - State: open - Opened by zuhalcakir 3 months ago

#25 - Bump Pip Version

Issue - State: open - Opened by O-Schilter 5 months ago

#24 - Discrepancy Between SMILES and Corresponding Image in `acs.csv`

Issue - State: open - Opened by puchapu 5 months ago

#23 - fixes #22

Pull Request - State: open - Opened by eloyfelix 5 months ago

#22 - molscribe hangs indefinetly with .tif file from USPTO grant red book

Issue - State: open - Opened by nbosc 6 months ago - 2 comments

#21 - 当一个batch中，推理两条完全一样的图片，产生的结果不一致。

Issue - State: closed - Opened by DaXia-Yang 7 months ago - 2 comments

#20 - fix a bug about case like (CH2)5

Pull Request - State: open - Opened by Waterdrop-One 8 months ago

#19 - Generating molecules

Issue - State: open - Opened by path-to-freedom 8 months ago - 1 comment

#18 - Correct metrics to compare with the paper?

Issue - State: closed - Opened by rytheranderson 8 months ago - 3 comments

#17 - Make multiprocessing configurable and disable by default

Pull Request - State: closed - Opened by tobbber 9 months ago - 2 comments

#16 - 我发现后处理的一个BUG

Issue - State: open - Opened by Waterdrop-One 9 months ago - 1 comment

#15 - regarding stereochemistry

Issue - State: closed - Opened by shubbey 9 months ago - 3 comments

#14 - Better performance when not using multiprocessing

Issue - State: closed - Opened by tobbber 9 months ago - 2 comments

#13 - USPTO images missing for the "small" train script

Issue - State: open - Opened by rytheranderson 9 months ago - 2 comments

#12 - Running in a Jupyter notebook works nicely. Running as a .py causes my computer to freeze due to insane cpu usage.

Issue - State: open - Opened by willfinnigan 11 months ago - 3 comments

#11 - How to convert Raw_SMILES to SMILES

Issue - State: closed - Opened by freewind2213 11 months ago - 2 comments

#10 - Bad Result when trying to train model with input is images

Issue - State: open - Opened by qbKhanh 12 months ago

#9 - 感谢你开源的MolScribe模型，已经试用了，准确性还不错。想请教一下，关于分子位置检测有推荐的开源模型吗？

Issue - State: closed - Opened by SnailWhb about 1 year ago - 7 comments

#8 - Molfile preprocess code

Issue - State: closed - Opened by KirigiriSuzumiya about 1 year ago - 1 comment

#7 - RuntimeError: one of the variables needed for gradient computation has been modified by an inplace operation

Issue - State: closed - Opened by qbKhanh about 1 year ago - 8 comments

#6 - cannot import name 'safe_rotate_enlarged_img_size' from 'albumentations.augmentations.geometric.functional'

Issue - State: closed - Opened by qbKhanh about 1 year ago - 5 comments

#5 - Update setup.py

Pull Request - State: closed - Opened by deimos1078 about 1 year ago

#4 - Images that do not contain chemical structures are less effective

Issue - State: closed - Opened by echo0218 over 1 year ago - 1 comment

#3 - Installation error- "Building wheel for grpcio (setup.py) ... error"

Issue - State: open - Opened by sberthel over 1 year ago

#2 - Please release the code about generating *.csv file for uspto_mol dataset

Issue - State: closed - Opened by wanghan0501 over 1 year ago - 6 comments

#1 - file vocab/vocab_chars.json not available

Issue - State: closed - Opened by molden over 1 year ago - 2 comments

Ecosyste.ms: Issues

GitHub / thomas0809/MolScribe issues and pull requests