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	<title>White Paper Archives - X-Chem</title>
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		<title>ArtemisAI: An Innovative Machine Learning Platform Benchmarked for ADMET Prediction</title>
		<link>https://www.x-chemrx.com/projects/artemisai-an-innovative-machine-learning-platform-benchmarked-for-admet-prediction/</link>
					<comments>https://www.x-chemrx.com/projects/artemisai-an-innovative-machine-learning-platform-benchmarked-for-admet-prediction/#respond</comments>
		
		<dc:creator><![CDATA[AdminGG]]></dc:creator>
		<pubDate>Wed, 03 Jan 2024 18:34:57 +0000</pubDate>
				<guid isPermaLink="false">https://ggdev9.com/?post_type=avada_portfolio&#038;p=3648</guid>

					<description><![CDATA[<p>The integration of artificial intelligence technologies into pharmaceutical research is showing promising results in both effectiveness and efficiency. Developing an early understanding of absorption, distribution, metabolism, excretion, and toxicity (ADMET) endpoints is crucial to the success of drug de-sign projects. In this study, we present an innovative automatic machine learning platform, named ArtemisAI. The  [...]</p>
<p>The post <a href="https://www.x-chemrx.com/projects/artemisai-an-innovative-machine-learning-platform-benchmarked-for-admet-prediction/">ArtemisAI: An Innovative Machine Learning Platform Benchmarked for ADMET Prediction</a> appeared first on <a href="https://www.x-chemrx.com">X-Chem</a>.</p>
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										<content:encoded><![CDATA[<div class="fusion-fullwidth fullwidth-box fusion-builder-row-1 fusion-flex-container has-pattern-background has-mask-background nonhundred-percent-fullwidth non-hundred-percent-height-scrolling" style="--awb-border-radius-top-left:0px;--awb-border-radius-top-right:0px;--awb-border-radius-bottom-right:0px;--awb-border-radius-bottom-left:0px;--awb-flex-wrap:wrap;" ><div class="fusion-builder-row fusion-row fusion-flex-align-items-flex-start fusion-flex-content-wrap" style="max-width:1248px;margin-left: calc(-4% / 2 );margin-right: calc(-4% / 2 );"><div class="fusion-layout-column fusion_builder_column fusion-builder-column-0 fusion_builder_column_2_3 2_3 fusion-flex-column" style="--awb-bg-size:cover;--awb-width-large:66.666666666667%;--awb-spacing-right-large:2.88%;--awb-margin-bottom-large:0px;--awb-spacing-left-large:2.88%;--awb-width-medium:66.666666666667%;--awb-order-medium:0;--awb-spacing-right-medium:2.88%;--awb-spacing-left-medium:2.88%;--awb-width-small:100%;--awb-order-small:0;--awb-spacing-right-small:1.92%;--awb-spacing-left-small:1.92%;"><div class="fusion-column-wrapper fusion-column-has-shadow fusion-flex-justify-content-flex-start fusion-content-layout-column"><div class="fusion-text fusion-text-1"><p>The integration of artificial intelligence technologies into pharmaceutical research is showing promising results in both effectiveness and efficiency. Developing an early understanding of absorption, distribution, metabolism, excretion, and toxicity (ADMET) endpoints is crucial to the success of drug de-sign projects. In this study, we present an innovative automatic machine learning platform, named ArtemisAI. The proposed platform offers a fully automated end-to-end pipeline, encompassing feature preprocessing, training and validation, model tuning, and eventual model selection, all conducted with-out human intervention. We employ the proposed platform for in silico ADMET endpoint prediction, and benchmark it against four state-of-the-art baseline models/platforms on the Therapeutic Data Commons (TDC) ADMET datasets. In 17 out of the 22 examined ADMET datasets, ArtemisAI stands out as a top-performing approach, demonstrating superior performance over these instances. For the remaining instances, ArtemisAI consistently ranks within the top two performers. The experimental outcomes showcase the effectiveness and robustness of ArtemisAI on diverse ADMET endpoint prediction tasks.</p>
</div></div></div><div class="fusion-layout-column fusion_builder_column fusion-builder-column-1 fusion_builder_column_1_3 1_3 fusion-flex-column" style="--awb-bg-size:cover;--awb-width-large:33.333333333333%;--awb-spacing-right-large:5.76%;--awb-margin-bottom-large:0px;--awb-spacing-left-large:5.76%;--awb-width-medium:33.333333333333%;--awb-order-medium:0;--awb-spacing-right-medium:5.76%;--awb-spacing-left-medium:5.76%;--awb-width-small:100%;--awb-order-small:0;--awb-spacing-right-small:1.92%;--awb-spacing-left-small:1.92%;"><div class="fusion-column-wrapper fusion-column-has-shadow fusion-flex-justify-content-flex-start fusion-content-layout-column"><div ><a class="fusion-button button-flat fusion-button-default-size button-default fusion-button-default button-1 fusion-button-span-yes fusion-button-default-type" target="_blank" rel="noopener noreferrer" href="https://www.x-chemrx.com/wp-content/uploads/2025/06/X-Chem-ArtemisAI-White-Paper-sm.pdf"><i class="fa-file-pdf fas awb-button__icon awb-button__icon--default button-icon-left" aria-hidden="true"></i><span class="fusion-button-text awb-button__text awb-button__text--default">View Full PDF</span></a></div><div class="fusion-text fusion-text-2" style="--awb-font-size:15px;--awb-margin-top:10px;">
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<p>The post <a href="https://www.x-chemrx.com/projects/artemisai-an-innovative-machine-learning-platform-benchmarked-for-admet-prediction/">ArtemisAI: An Innovative Machine Learning Platform Benchmarked for ADMET Prediction</a> appeared first on <a href="https://www.x-chemrx.com">X-Chem</a>.</p>
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