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DockTox: Targeting molecular initiating events in organ toxicity through molecular docking DockTox:通过分子对接靶向器官毒性的起始分子事件 Ortega-Vallbona, Rita; Talavera-Cortes, David; Carpio, Laureano E.; Palacio, Jessica Coto; Roncaglioni, Alessandra; De Lomana, Marina Garcia; Gadaleta, Domenico; Benfenati, Emilio; Gozalbes, Rafael; Serrano-Candelas, Eva 分享 收藏
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Comprehensive benchmarking of computational tools for predicting toxicokinetic and physicochemical properties of chemicals Gadaleta, Domenico; Serrano-Candelas, Eva; Ortega-Vallbona, Rita; Colombo, Erika; de Lomana, Marina Garcia; Biava, Giada; Aparicio-Sanchez, Pablo; Roncaglioni, Alessandra; Gozalbes, Rafael; Benfenati, Emilio 分享 收藏
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Novel clinical phenotypes, drug categorization, and outcome prediction in drug-induced cholestasis: Analysis of a database of 432 patients developed by literature review and machine learning support (vol 174, 116560, 2024) 药物引起的胆汁淤积症的新型临床表型,药物分类和结果预测: 通过文献综述和机器学习支持开发的432例患者数据库分析 (174卷,116560,2024) Moreno-Torres, Marta; Lopez-Pascual, Ernesto; Rapisarda, Anna; Quintas, Guillermo; Drees, Annika; Steffensen, Inger-Lise; Luechtefeld, Thomas; Serrano-Candelas, Eva; de Lomana, Marina Garcia; Gadaleta, Domenico; Dirven, Hubert; Vinken, Mathieu; Jover, Ramiro 分享 收藏
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Novel clinical phenotypes, drug categorization, and outcome prediction in drug-induced cholestasis: Analysis of a database of 432 patients developed by literature review and machine learning support 药物引起的胆汁淤积症的新型临床表型,药物分类和结果预测: 通过文献综述和机器学习支持开发的432例患者数据库分析 Moreno-Torres, Marta; Lopez-Pascual, Ernesto; Rapisarda, Anna; Quintas, Guillermo; Drees, Annika; Steffensen, Inger-Lise; Luechtefeld, Thomas; Serrano-Candelas, Eva; de Lomana, Marina Garcia; Gadaleta, Domenico; Dirven, Hubert; Vinken, Mathieu; Jover, Ramiro 分享 收藏
Collaborative SAR Modeling and Prospective In Vitro Validation of Oxidative Stress Activation in Human HepG2 Cells Bequignon, Olivier J. M.; Gomez-Tamayo, Jose C.; Lenselink, Eelke B.; Wink, Steven; Hiemstra, Steven; Lam, Chi Chung; Gadaleta, Domenico; Roncaglioni, Alessandra; Norinder, Ulf; Water, Bob van de; Pastor, Manuel; van Westen, Gerard J. P. 分享 收藏
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Integrate mechanistic evidence from new approach methodologies (NAMs) into a read-across assessment to characterise trends in shared mode of action Escher, Sylvia E.; Aguayo-Orozco, Alejandro; Benfenati, Emilio; Bitsch, Annette; Braunbeck, Thomas; Brotzmann, Katharina; Bois, Frederic; van der Burg, Bart; Castel, Jose; Exner, Thomas; Gadaleta, Domenico; Gardner, Iain; Goldmann, Daria; Hatley, Oliver; Golbamaki, Nazanin; Graepel, Rabea; Jennings, Paul; Limonciel, Alice; Long, Anthony; Maclennan, Richard; Mombelli, Enrico; Norinder, Ulf; Jain, Sankalp; Capinha, Liliana Santos; Taboureau, Olivier T.; Tolosa, Laia; Vrijenhoek, Nanette G.; Van Vugt-Lussenburg, Barbara M. A.; Walker, Paul; van de Water, Bob; Wehr, Matthias; White, Andrew; Zdrazil, Barbara; Fisher, Ciaran 分享 收藏
CATMoS: Collaborative Acute Toxicity Modeling Suite (vol 129, 047013, 2021) CATMoS: 协作式急性毒性建模套件 (129卷,047013,2021) Mansouri, Kamel; Karmaus, Agnes L.; Fitzpatrick, Jeremy; Patlewicz, Grace; Pradeep, Prachi; Alberga, Domenico; Alepee, Nathalie; Allen, Timothy E. H.; Allen, Dave; Alves, Vinicius M.; Andrade, Carolina H.; Auernhammer, Tyler R.; Ballabio, Davide; Bell, Shannon; Benfenati, Emilio; Bhattacharya, Sudin; V. Bastos, Joyce; Boyd, Stephen; Brown, J. B.; Capuzzi, Stephen J.; Chushak, Yaroslav; Ciallella, Heather; Clark, Alex M.; Consonni, Viviana; Daga, Pankaj R.; Ekins, Sean; Farag, Sherif; Fedorov, Maxim; Fourches, Denis; Gadaleta, Domenico; Gao, Feng; Gearhart, Jeffery M.; Goh, Garett; Goodman, Jonathan M.; Grisoni, Francesca; Grulke, Christopher M.; Hartung, Thomas; Hirn, Matthew; Karpov, Pavel; Korotcov, Alexandru; Lavado, Giovanna J.; Lawless, Michael; Li, Xinhao; Luechtefeld, Thomas; Lunghini, Filippo; Mangiatordi, Giuseppe F.; Marcou, Gilles; Marsh, Dan; Martin, Todd; Mauri, Andrea; Muratov, Eugene N.; Myatt, Glenn J.; Nguyen, Dac-Trung; Nicolotti, Orazio; Note, Reine; Pande, Paritosh; Parks, Amanda K.; Peryea, Tyler; Polash, Ahsan H.; Rallo, Robert; Roncaglioni, Alessandra; Rowlands, Craig; Ruiz, Patricia; Russo, Daniel P.; Sayed, Ahmed; Sayre, Risa; Sheils, Timothy; Siegel, Charles; Silva, Arthur C.; Simeonov, Anton; Sosnin, Sergey; Southall, Noel; Strickland, Judy; Tang, Yun; Teppen, Brian; V. Tetko, Igor; Thomas, Dennis; Tkachenko, Valery; Todeschini, Roberto; Toma, Cosimo; Tripodi, Ignacio; Trisciuzzi, Daniela; Tropsha, Alexander; Varnek, Alexandre; Vukovic, Kristijan; Wang, Zhongyu; Wang, Liguo; Waters, Katrina M.; Wedlake, Andrew J.; Wijeyesakere, Sanjeeva J.; Wilson, Dan; Xiao, Zijun; Yang, Hongbin; Zahoranszky-Kohalmi, Gergely; V. Zakharov, Alexey; Zhang, Fagen F.; Zhang, Zhen; Zhao, Tongan; Zhu, Hao; Zorn, Kimberley M.; Casey, Warren; Kleinstreuer, Nicole C. 分享 收藏
CATMoS: Collaborative Acute Toxicity Modeling Suite (vol 129, 047013, 2021) Mansouri, Kamel; Karmaus, Agnes; Fitzpatrick, Jeremy; Patlewicz, Grace; Pradeep, Prachi; Alberga, Domenico; Alepee, Nathalie; Allen, Timothy E. H.; Allen, Dave; Alves, Vinicius M.; Andrade, Carolina H.; Auernhammer, Tyler R.; Ballabio, Davide; Bell, Shannon; Benfenati, Emilio; Bhattacharya, Sudin; V. Bastos, Joyce; Boyd, Stephen; Brown, J. B.; Capuzzi, Stephen J.; Chushak, Yaroslav; Ciallella, Heather; Clark, Alex M.; Consonni, Viviana; Daga, Pankaj R.; Ekins, Sean; Farag, Sherif; Fedorov, Maxim; Fourches, Denis; Gadaleta, Domenico; Gao, Feng; Gearhart, Jeffery M.; Goh, Garett; Goodman, Jonathan M.; Grisoni, Francesca; Grulke, Christopher M.; Hartung, Thomas; Hirn, Matthew; Karpov, Pavel; Korotcov, Alexandru; Lavado, Giovanna J.; Lawless, Michael; Li, Xinhao; Luechtefeld, Thomas; Lunghini, Filippo; Mangiatordi, Giuseppe F.; Marcou, Gilles; Marsh, Dan; Martin, Todd; Mauri, Andrea; Muratov, Eugene N.; Myatt, Glenn J.; Nguyen, Dac-Trung; Nicolotti, Orazio; Note, Reine; Pande, Paritosh; Parks, Amanda K.; Peryea, Tyler; Polash, Ahsan; Rallo, Robert; Roncaglioni, Alessandra; Rowlands, Craig; Ruiz, Patricia; Russo, Daniel; Sayed, Ahmed; Sayre, Risa; Sheils, Timothy; Siegel, Charles; Silva, Arthur C.; Simeonov, Anton; Sosnin, Sergey; Southall, Noel; Strickland, Judy; Tang, Yun; Teppen, Brian; V. Tetko, Igor; Thomas, Dennis; Tkachenko, Valery; Todeschini, Roberto; Toma, Cosimo; Tripodi, Ignacio; Trisciuzzi, Daniela; Tropsha, Alexander; Varnek, Alexandre; Vukovic, Kristijan; Wang, Zhongyu; Wang, Liguo; Waters, Katrina M.; Wedlake, Andrew J.; Wijeyesakere, Sanjeeva J.; Wilson, Dan; Xiao, Zijun; Yang, Hongbin; Zahoranszky-Kohalmi, Gergely; V. Zakharov, Alexey; Zhang, Fagen F.; Zhang, Zhen; Zhao, Tongan; Zhu, Hao; Zorn, Kimberley M.; Casey, Warren; Kleinstreuer, Nicole C. 分享 收藏
CATMoS: Collaborative Acute Toxicity Modeling Suite Mansouri, Kamel; Karmaus, Agnes L.; Fitzpatrick, Jeremy; Patlewicz, Grace; Pradeep, Prachi; Alberga, Domenico; Alepee, Nathalie; Allen, Timothy E. H.; Allen, Dave; Alves, Vinicius M.; Andrade, Carolina H.; Auernhammer, Tyler R.; Ballabio, Davide; Bell, Shannon; Benfenati, Emilio; Bhattacharya, Sudin; Bastos, Joyce, V; Boyd, Stephen; Brown, J. B.; Capuzzi, Stephen J.; Chushak, Yaroslav; Ciallella, Heather; Clark, Alex M.; Consonni, Viviana; Daga, Pankaj R.; Ekins, Sean; Farag, Sherif; Fedorov, Maxim; Fourches, Denis; Gadaleta, Domenico; Gao, Feng; Gearhart, Jeffery M.; Goh, Garett; Goodman, Jonathan M.; Grisoni, Francesca; Grulke, Christopher M.; Hartung, Thomas; Hirn, Matthew; Karpov, Pavel; Korotcov, Alexandru; Lavado, Giovanna J.; Lawless, Michael; Li, Xinhao; Luechtefeld, Thomas; Lunghini, Filippo; Mangiatordi, Giuseppe F.; Marcou, Gilles; Marsh, Dan; Martin, Todd; Mauri, Andrea; Muratov, Eugene N.; Myatt, Glenn J.; Dac-Trung Nguyen; Nicolotti, Orazio; Note, Reine; Pande, Paritosh; Parks, Amanda K.; Peryea, Tyler; Polash, Ahsan H.; Rallo, Robert; Roncaglioni, Alessandra; Rowlands, Craig; Ruiz, Patricia; Russo, Daniel P.; Sayed, Ahmed; Sayre, Risa; Sheils, Timothy; Siegel, Charles; Silva, Arthur C.; Simeonov, Anton; Sosnin, Sergey; Southall, Noel; Strickland, Judy; Tang, Yun; Teppen, Brian; Tetko, Igor, V; Thomas, Dennis; Tkachenko, Valery; Todeschini, Roberto; Toma, Cosimo; Tripodi, Ignacio; Trisciuzzi, Daniela; Tropsha, Alexander; Varnek, Alexandre; Vukovic, Kristijan; Wang, Zhongyu; Wang, Liguo; Waters, Katrina M.; Wedlake, Andrew J.; Wijeyesakere, Sanjeeva J.; Wilson, Dan; Xiao, Zijun; Yang, Hongbin; Zahoranszky-Kohalmi, Gergely; Zakharov, Alexey, V; Zhang, Fagen F.; Zhang, Zhen; Zhao, Tongan; Zhu, Hao; Zorn, Kimberley M.; Casey, Warren; Kleinstreuer, Nicole C. 分享 收藏
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Zebrafish AC50 modelling: (Q)SAR models to predict developmental toxicity in zebrafish embryo 斑马鱼AC50建模 :( Q)SAR模型预测斑马鱼胚胎的发育毒性 Lavado, Giovanna J.; Gadaleta, Domenico; Toma, Cosimo; Golbamaki, Azadi; Toropov, Andrey A.; Toropova, Alla P.; Marzo, Marco; Baderna, Diego; Arning, Juergen; Benfenati, Emilio 分享 收藏