Radical-Net: A chemistry-enhanced transformer for elementary radical reactions in pollutant chemistry
Zhi Huang, Jiang Yu, Jiang Yu, Wei He, Peng Huang, Siwei Deng, Hongbin Jiang, Jie Yu, Jie Yu, Chun Yang, Cheng Han, Yinying Jiang, Weiwei Zhu, Yucheng Liu
Topics & Concepts
ChemistryInterpretabilityRadicalHazardous wastePollutantElementary reactionComputer scienceArtificial intelligenceGeneralizability theoryBiological systemTransformerEnvironmental remediationHazardous air pollutantsDimensionality reductionMicrogridMachine learningCurse of dimensionalityBiochemical engineeringComputational chemistryMachine Learning in Materials ScienceRadical Photochemical ReactionsComputational Drug Discovery Methods