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Designing highly potent compounds using a chemical language model

Scientific reports, 2023-05, Vol.13 (1), p.7412-7412, Article 7412

2023

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Meta-learning for transformer-based prediction of potent compounds

Scientific reports, 2023-09, Vol.13 (1), p.16145-16145, Article 16145

2023

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Generative design of compounds with desired potency from target protein sequences using a multimodal biochemical language model

Journal of cheminformatics, 2024-05, Vol.16 (1), p.55-55, Article 55

2024

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Gene Expression Data Based Deep Learning Model for Accurate Prediction of Drug-Induced Liver Injury in Advance

Journal of chemical information and modeling, 2019-07, Vol.59 (7), p.3240-3250

2019

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DeepAC – conditional transformer-based chemical language model for the prediction of activity cliffs formed by bioactive compounds

Digital discovery, 2022-12, Vol.1 (6), p.898-909

2022

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DeepCubist: Molecular Generator for Designing Peptidomimetics based on Complex three-dimensional scaffolds

Journal of computer-aided molecular design, 2023-02, Vol.37 (2), p.107-115

2023

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Deep learning-based multi-drug synergy prediction model for individually tailored anti-cancer therapies

Frontiers in pharmacology, 2022-12, Vol.13, p.1032875

2022

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Apatinib combined with camrelizumab in the treatment of recurrent/metastatic nasopharyngeal carcinoma: a prospective multicenter phase II study

Frontiers in immunology, 2024-01, Vol.14, p.1298418-1298418

2024

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Optimization Strategy for Generating Gene-edited Tibet Minipigs by Synchronized Oestrus and Cytoplasmic Microinjection

International journal of biological sciences, 2019-01, Vol.15 (12), p.2719-2732

2019

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RFAP: A Revocable Fine-Grained Access Control Mechanism for Autonomous Vehicle Platoon

IEEE transactions on intelligent transportation systems, 2022-07, Vol.23 (7), p.9668-9679

2022

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Extension of multi-site analogue series with potent compounds using a bidirectional transformer-based chemical language model

RSC medicinal chemistry, 2024-07, Vol.15 (7), p.2527-2537

2024

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Chemical language models for applications in medicinal chemistry

Future medicinal chemistry, 2023-01, Vol.15 (1), p.119-121

2023

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A Strategy for the Effective Optimization of Pharmaceutical Formulations Based on Parameter-Optimized Support Vector Machine Model

AAPS PharmSciTech, 2022-01, Vol.23 (1), p.66-66, Article 66

2022

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Prediction model for synergistic anti-tumor multi-compound combinations from traditional Chinese medicine based on extreme gradient boosting, targets and gene expression data

Journal of bioinformatics and computational biology, 2022-06, Vol.20 (3)

2022

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Detecting complex indels with wide length-spectrum from the third generation sequencing data

2017 IEEE International Conference on Bioinformatics and Biomedicine (BIBM), 2017, p.1980-1987

2017

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Wind awareness for energy consumption in drone simulations (demo paper)

Proceedings of the 30th International Conference on Advances in Geographic Information Systems, 2022, p.1-4

2022

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Evanescent Wave Absorption Sensor Based Tapered Plastic Optical Fiber Coated with Monolayer Graphene for Ethanol Molecules Detection

Chinese journal of chemistry, 2016-10, Vol.34 (10), p.1039-1047

2016

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Atomically dispersed iron hydroxide anchored on Pt for preferential oxidation of CO in H2

Nature (London), 2019-01, Vol.565 (7741), p.631-635

2019

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Constructing a plasmonic p-n heterojunction photocatalyst of 3D Ag/Ag6Si2O7/Bi2MoO6 for efficiently removing broad-spectrum antibiotics

Separation and purification technology, 2021-01, Vol.254, p.117579, Article 117579

2021

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Singlet Oxygen-Engaged Selective Photo-Oxidation over Pt Nanocrystals/Porphyrinic MOF: The Roles of Photothermal Effect and Pt Electronic State

Journal of the American Chemical Society, 2017-02, Vol.139 (5), p.2035-2044

2017

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Single-cell RNA landscape of the osteoimmunology microenvironment in periodontitis

Theranostics, 2022, Vol.12 (3), p.1074-1096

2022

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High-entropy induced a glass-to-glass transition in a metallic glass

Nature communications, 2022-04, Vol.13 (1), p.2183-2183, Article 2183

2022

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Role of Inflammatory Factors in Mediating the Effect of Lipids on Nonalcoholic Fatty Liver Disease: A Two-Step, Multivariable Mendelian Randomization Study

Nutrients, 2022-10, Vol.14 (20), p.4434

2022

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Intelligent Solutions in Chest Abnormality Detection Based on YOLOv5 and ResNet50

Journal of healthcare engineering, 2021-10, Vol.2021, p.1-11

2021

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Macroscopic and microscopic experimental research on granite properties after high-temperature and water-cooling cycles

Geothermics, 2021-06, Vol.93, p.102079, Article 102079

2021

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Designing highly potent compounds using a chemical language model

Meta-learning for transformer-based prediction of potent compounds

Generative design of compounds with desired potency from target protein sequences using a multimodal biochemical language model

Gene Expression Data Based Deep Learning Model for Accurate Prediction of Drug-Induced Liver Injury in Advance

DeepAC – conditional transformer-based chemical language model for the prediction of activity cliffs formed by bioactive compounds

DeepCubist: Molecular Generator for Designing Peptidomimetics based on Complex three-dimensional scaffolds

Deep learning-based multi-drug synergy prediction model for individually tailored anti-cancer therapies

Apatinib combined with camrelizumab in the treatment of recurrent/metastatic nasopharyngeal carcinoma: a prospective multicenter phase II study

Optimization Strategy for Generating Gene-edited Tibet Minipigs by Synchronized Oestrus and Cytoplasmic Microinjection

RFAP: A Revocable Fine-Grained Access Control Mechanism for Autonomous Vehicle Platoon

Extension of multi-site analogue series with potent compounds using a bidirectional transformer-based chemical language model

Chemical language models for applications in medicinal chemistry

A Strategy for the Effective Optimization of Pharmaceutical Formulations Based on Parameter-Optimized Support Vector Machine Model

Prediction model for synergistic anti-tumor multi-compound combinations from traditional Chinese medicine based on extreme gradient boosting, targets and gene expression data

Detecting complex indels with wide length-spectrum from the third generation sequencing data

Wind awareness for energy consumption in drone simulations (demo paper)

Evanescent Wave Absorption Sensor Based Tapered Plastic Optical Fiber Coated with Monolayer Graphene for Ethanol Molecules Detection

Atomically dispersed iron hydroxide anchored on Pt for preferential oxidation of CO in H2

Constructing a plasmonic p-n heterojunction photocatalyst of 3D Ag/Ag6Si2O7/Bi2MoO6 for efficiently removing broad-spectrum antibiotics

Singlet Oxygen-Engaged Selective Photo-Oxidation over Pt Nanocrystals/Porphyrinic MOF: The Roles of Photothermal Effect and Pt Electronic State

Single-cell RNA landscape of the osteoimmunology microenvironment in periodontitis

High-entropy induced a glass-to-glass transition in a metallic glass

Role of Inflammatory Factors in Mediating the Effect of Lipids on Nonalcoholic Fatty Liver Disease: A Two-Step, Multivariable Mendelian Randomization Study

Intelligent Solutions in Chest Abnormality Detection Based on YOLOv5 and ResNet50

Macroscopic and microscopic experimental research on granite properties after high-temperature and water-cooling cycles

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