Atomistic Description
태스크의 하위 분류와 논문·코드·평가·기법·데이터셋을 탐색하세요.
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- 평가표
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- 보존된 평가 기록
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코드
관련 논문과 평가 결과에 연결된 구현입니다. 출처에서 확인된 저자 구현에는 공식 코드 표시가 있습니다.
https://github.com/shi27feng/transformers.satisfy
https://github.com/smiles724/protmd
Molecular Mechanics-Driven Graph Neural Network with Multiplex Graph for Molecular Structures
https://github.com/snap-stanford/pretrain-gnns
https://github.com/snowkylin/gnn
https://github.com/snownus/COOP
https://github.com/steshinss/lohi_neurips2023
https://github.com/steshinss/lohi_splitter
https://github.com/subercui/pyGConvAT
https://github.com/sunxiaobei/mindspore_gallery/tree/main/grl/gcn
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/taishan1994/pytorch_gat
https://github.com/tatp22/pytorch-fast-GAT
https://github.com/teddykoker/e3nn.c
Learning Local Equivariant Representations for Large-Scale Atomistic Dynamics
https://github.com/teddykoker/mpnn-for-quantum-chem
https://github.com/tencent-alchemy/Alchemy
Molecular Property Prediction: A Multilevel Quantum Interactions Modeling Perspective
https://github.com/tensorflow/gnn/blob/main/tensorflow_gnn/docs/api_docs/python/gnn/keras/layers/GATv2.md
https://github.com/thanhtrunghuynh93/pygcn
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/thumnlab/autogl-light
Uncertainty Quantification for Molecular Property Predictions with Graph Neural Architecture Search
https://github.com/tingweidaniel/chemprop_atomicfp_save_depth_final
Analyzing Learned Molecular Representations for Property Prediction
https://github.com/tisabe/jraph_mpeu
Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials
https://github.com/tk-rusch/graphcon
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/tkipf/gcn
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/tkipf/keras-gcn
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/tlmakinen/GAT-noise
https://github.com/toinesayan/node-classification-and-label-dependencies
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/tomdbar/eco-dqn
https://github.com/toshi-k/kaggle-champs-scalar-coupling
Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials
https://github.com/toshi-k/kaggle-trends-assessment-prediction
Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials
https://github.com/tuananh0305/GCN_ANOMALY_DETECTION
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/udlf/wsef
Semi-Supervised Classification with Graph Convolutional Networks
https://github.com/vailatuts/SSFG-regularization
https://github.com/vnoves/aectech2019-sketchto3d-backend
Hierarchical Surface Prediction for 3D Object Reconstruction
https://github.com/wan2000/mc-mot
https://github.com/weiyangfb/PyTorchSparseGAT
https://github.com/wengong-jin/abdockgen
Antibody-Antigen Docking and Design via Hierarchical Equivariant Refinement
https://github.com/whut2962575697/gat_sementic_segmentation
출처: Papers with Code · CC BY-SA 4.0. 아카이브 자료와 새로 수집한 논문은 별도로 관리합니다.