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Journal of chemical information and modeling, 2012-01, Vol.52 (1), p.134-145
2012
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Journal of chemical information and modeling, 2022-02, Vol.62 (3), p.718-729
- Zahoránszky-Kőhalmi, Gergely
- Siramshetty, Vishal B.
- Kumar, Praveen
- Gurumurthy, Manideep
- Grillo, Busola
- Mathew, Biju
- Metaxatos, Dimitrios
- Backus, Mark
- Mierzwa, Tim
- Simon, Reid
- Grishagin, Ivan
- Brovold, Laura
- Mathé, Ewy A.
- Hall, Matthew D.
- Michael, Samuel G.
- Godfrey, Alexander G.
- Mestres, Jordi
- Jensen, Lars J.
- Oprea, Tudor I.
2022
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Cell reports (Cambridge), 2020-06, Vol.31 (11), p.107770-107770, Article 107770
2020
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Frontiers in robotics and AI, 2020-02, Vol.7, p.24-24
2020
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Journal of cheminformatics, 2016-03, Vol.8 (1), p.16-16, Article 16
2016
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Cell reports (Cambridge), 2021-04, Vol.35 (4), p.109040-109040, Article 109040
- Henderson, Mark J.
- Trychta, Kathleen A.
- Yang, Shyh-Ming
- Bäck, Susanne
- Yasgar, Adam
- Wires, Emily S.
- Danchik, Carina
- Yan, Xiaokang
- Yano, Hideaki
- Shi, Lei
- Wu, Kuo-Jen
- Wang, Amy Q.
- Tao, Dingyin
- Zahoránszky-Kőhalmi, Gergely
- Hu, Xin
- Xu, Xin
- Maloney, David
- Zakharov, Alexey V.
- Rai, Ganesha
- Urano, Fumihiko
- Airavaara, Mikko
- Gavrilova, Oksana
- Jadhav, Ajit
- Wang, Yun
- Simeonov, Anton
- Harvey, Brandon K.
2021
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BMC structural biology, 2010-10, Vol.10 (1), p.32-32, Article 32
2010
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Nature reviews. Drug discovery, 2018-05, Vol.17 (5), p.317-332
- Oprea, Tudor I
- Bologa, Cristian G
- Brunak, Søren
- Campbell, Allen
- Gan, Gregory N
- Gaulton, Anna
- Gomez, Shawn M
- Guha, Rajarshi
- Hersey, Anne
- Holmes, Jayme
- Jadhav, Ajit
- Jensen, Lars Juhl
- Johnson, Gary L
- Karlson, Anneli
- Leach, Andrew R
- Ma'ayan, Avi
- Malovannaya, Anna
- Mani, Subramani
- Mathias, Stephen L
- McManus, Michael T
- Meehan, Terrence F
- von Mering, Christian
- Muthas, Daniel
- Nguyen, Dac-Trung
- Overington, John P
- Papadatos, George
- Qin, Jun
- Reich, Christian
- Roth, Bryan L
- Schürer, Stephan C
- Simeonov, Anton
- Sklar, Larry A
- Southall, Noel
- Tomita, Susumu
- Tudose, Ilinca
- Ursu, Oleg
- Vidovic, Dušica
- Waller, Anna
- Westergaard, David
- Yang, Jeremy J
- Zahoránszky-Köhalmi, Gergely
2018
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Journal of cheminformatics, 2020-01, Vol.12 (1), p.5-11, Article 5
2020
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Environmental health perspectives, 2021-04, Vol.129 (4), p.47013
- 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
- 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
- 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
2021
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Journal of cheminformatics, 2016-05, Vol.8 (1), p.28-28, Article 28
2016
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Environmental health perspectives, 2021-10, Vol.129 (10), p.109001
- 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
- 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
- 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
2021
Link zum Volltext
Environmental health perspectives, 2021-07, Vol.129 (7)
- 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
- 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
- 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
- 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
- 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.
2021
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ACS pharmacology & translational science, 2020-12, Vol.3 (6), p.1144-1157
2020
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Nature reviews. Drug discovery, 2018-05, Vol.17 (5), p.377-377
- Oprea, Tudor I
- Bologa, Cristian G
- Brunak, Søren
- Campbell, Allen
- Gan, Gregory N
- Gaulton, Anna
- Gomez, Shawn M
- Guha, Rajarshi
- Hersey, Anne
- Holmes, Jayme
- Jadhav, Ajit
- Jensen, Lars Juhl
- Johnson, Gary L
- Karlson, Anneli
- Leach, Andrew R
- Ma'ayan, Avi
- Malovannaya, Anna
- Mani, Subramani
- Mathias, Steven L
- McManus, Michael T
- Meehan, Terrence F
- von Mering, Christian
- Muthas, Daniel
- Nguyen, Dac-Trung
- Overington, John P
- Papadatos, George
- Qin, Jun
- Reich, Christian
- Roth, Bryan L
- Schürer, Stephan C
- Simeonov, Anton
- Sklar, Larry A
- Southall, Noel
- Tomita, Susumu
- Tudose, Ilinca
- Ursu, Oleg
- Vidovic, Dušica
- Waller, Anna
- Westergaard, David
- Yang, Jeremy J
- Zahoránszky-Köhalmi, Gergely
2018
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Algorithms for molecular biology, 2009-10, Vol.4 (1), p.12-12, Article 12
2009
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ACS central science, 2018-12, Vol.4 (12), p.1727-1741
- Kearney, Sara E
- Zahoránszky-Kőhalmi, Gergely
- Brimacombe, Kyle R
- Henderson, Mark J
- Lynch, Caitlin
- Zhao, Tongan
- Wan, Kanny K
- Itkin, Zina
- Dillon, Christopher
- Shen, Min
- Cheff, Dorian M
- Lee, Tobie D
- Bougie, Danielle
- Cheng, Ken
- Coussens, Nathan P
- Dorjsuren, Dorjbal
- Eastman, Richard T
- Huang, Ruili
- Iannotti, Michael J
- Karavadhi, Surendra
- Klumpp-Thomas, Carleen
- Roth, Jacob S
- Sakamuru, Srilatha
- Sun, Wei
- Titus, Steven A
- Yasgar, Adam
- Zhang, Ya-Qin
- Zhao, Jinghua
- Andrade, Rodrigo B
- Brown, M. Kevin
- Burns, Noah Z
- Cha, Jin K
- Mevers, Emily E
- Clardy, Jon
- Clement, Jason A
- Crooks, Peter A
- Cuny, Gregory D
- Ganor, Jake
- Moreno, Jesus
- Morrill, Lucas A
- Picazo, Elias
- Susick, Robert B
- Garg, Neil K
- Goess, Brian C
- Grossman, Robert B
- Hughes, Chambers C
- Johnston, Jeffrey N
- Joullie, Madeleine M
- Kinghorn, A. Douglas
- Kingston, David G.I
- Krische, Michael J
- Kwon, Ohyun
- Maimone, Thomas J
- Majumdar, Susruta
- Maloney, Katherine N
- Mohamed, Enas
- Murphy, Brian T
- Nagorny, Pavel
- Olson, David E
- Overman, Larry E
- Brown, Lauren E
- Snyder, John K
- Porco, John A
- Rivas, Fatima
- Ross, Samir A
- Sarpong, Richmond
- Sharma, Indrajeet
- Shaw, Jared T
- Xu, Zhengren
- Shen, Ben
- Shi, Wei
- Stephenson, Corey R.J
- Verano, Alyssa L
- Tan, Derek S
- Tang, Yi
- Taylor, Richard E
- Thomson, Regan J
- Vosburg, David A
- Wu, Jimmy
- Wuest, William M
- Zakarian, Armen
- Zhang, Yufeng
- Ren, Tianjing
- Zuo, Zhong
- Inglese, James
- Michael, Sam
- Simeonov, Anton
- Zheng, Wei
- Shinn, Paul
- Jadhav, Ajit
- Boxer, Matthew B
- Hall, Matthew D
- Xia, Menghang
- Guha, Rajarshi
- Rohde, Jason M
2018
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Journal of chemical information and modeling, 2022-05, Vol.62 (9), p.2226-2238
2022
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Experimental biology and medicine (Maywood, N.J.), 2018-03, Vol.243 (6), p.538-553
2018
Link zum Volltext
Nature reviews. Drug discovery, 2018-03, Vol.17 (5), p.377-377
- Oprea, Tudor I.
- Bologa, Cristian G.
- Brunak, Søren
- Campbell, Allen
- Gan, Gregory N.
- Gaulton, Anna
- Gomez, Shawn M.
- Guha, Rajarshi
- Hersey, Anne
- Holmes, Jayme
- Jadhav, Ajit
- Jensen, Lars Juhl
- Johnson, Gary L.
- Karlson, Anneli
- Leach, Andrew R.
- Ma'ayan, Avi
- Malovannaya, Anna
- Mani, Subramani
- Mathias, Steven L.
- McManus, Michael T.
- Meehan, Terrence F.
- von Mering, Christian
- Muthas, Daniel
- Nguyen, Dac-Trung
- Overington, John P.
- Papadatos, George
- Qin, Jun
- Reich, Christian
- Roth, Bryan L.
- Schürer, Stephan C.
- Simeonov, Anton
- Sklar, Larry A.
- Southall, Noel
- Tomita, Susumu
- Tudose, Ilinca
- Ursu, Oleg
- Vidovic´, Dušica
- Waller, Anna
- Westergaard, David
- Yang, Jeremy J.
- Zahoránszky-Köhalmi, Gergely
2018
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