المؤلفون: Evans, Matthew L., Bergsma, Johan, Merkys, Andrius, Andersen, Casper W., Andersson, Oskar B., Beltrán, Daniel, Blokhin, Evgeny, Boland, Tara M., Balderas, Rubén Castañeda, Choudhary, Kamal, Díaz, Alberto Díaz, García, Rodrigo Domínguez, Eckert, Hagen, Eimre, Kristjan, Montero, María Elena Fuentes, Krajewski, Adam M., Mortensen, Jens Jørgen, Duarte, José Manuel Nápoles, Pietryga, Jacob, Qi, Ji, Carrillo, Felipe de Jesús Trejo, Vaitkus, Antanas, Yu, Jusong, Zettel, Adam, de Castro, Pedro Baptista, Carlsson, Johan, Cerqueira, Tiago F. T., Divilov, Simon, Hajiyani, Hamidreza, Hanke, Felix, Jose, Kevin, Oses, Corey, Riebesell, Janosh, Schmidt, Jonathan, Winston, Donald, Xie, Christen, Yang, Xiaoyu, Bonella, Sara, Botti, Silvana, Curtarolo, Stefano, Draxl, Claudia, Cobas, Luis Edmundo Fuentes, Hospital, Adam, Liu, Zi-Kui, Marques, Miguel A. L., Marzari, Nicola, Morris, Andrew J., Ong, Shyue Ping, Orozco, Modesto, Persson, Kristin A., Thygesen, Kristian S., Wolverton, Chris, Scheidgen, Markus, Toher, Cormac, Conduit, Gareth J., Pizzi, Giovanni, Gražulis, Saulius, Rignanese, Gian-Marco, Armiento, Rickard

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2402.00572

المؤلفون: Vaitkus, Antanas^{Aff1, IDs13321023007802_cor1}, Merkys, Andrius, Sander, Thomas, Quirós, Miguel, Thiessen, Paul A., Bolton, Evan E.^{Aff4, IDs13321023007802_cor6}, Gražulis, Saulius^{Aff1, Aff5}

المصدر: Journal of Cheminformatics. 15(1)

المؤلفون: Manakova, Elena, Golovinas, Edvardas, Pocevičiūtė, Reda, Sasnauskas, Giedrius, Grybauskas, Algirdas, Gražulis, Saulius, Zaremba, Mindaugas^{Aff1, IDs4159802332600w_cor7}

المصدر: Scientific Reports. 13(1)

المؤلفون: Merkys, Andrius^{Aff1, IDs13321023006921_cor1}, Vaitkus, Antanas, Grybauskas, Algirdas, Konovalovas, Aleksandras, Quirós, Miguel, Gražulis, Saulius

المصدر: Journal of Cheminformatics. 15(1)

المؤلفون: Andersen, Casper W., Armiento, Rickard, Blokhin, Evgeny, Conduit, Gareth J., Dwaraknath, Shyam, Evans, Matthew L., Fekete, Ádám, Gopakumar, Abhijith, Gražulis, Saulius, Merkys, Andrius, Mohamed, Fawzi, Oses, Corey, Pizzi, Giovanni, Rignanese, Gian-Marco, Scheidgen, Markus, Talirz, Leopold, Toher, Cormac, Winston, Donald, Aversa, Rossella, Choudhary, Kamal, Colinet, Pauline, Curtarolo, Stefano, Di Stefano, Davide, Draxl, Claudia, Er, Suleyman, Esters, Marco, Fornari, Marco, Giantomassi, Matteo, Govoni, Marco, Hautier, Geoffroy, Hegde, Vinay, Horton, Matthew K., Huck, Patrick, Huhs, Georg, Hummelshøj, Jens, Kariryaa, Ankit, Kozinsky, Boris, Kumbhar, Snehal, Liu, Mohan, Marzari, Nicola, Morris, Andrew J., Mostofi, Arash, Persson, Kristin A., Petretto, Guido, Purcell, Thomas, Ricci, Francesco, Rose, Frisco, Scheffler, Matthias, Speckhard, Daniel, Uhrin, Martin, Vaitkus, Antanas, Villars, Pierre, Waroquiers, David, Wolverton, Chris, Wu, Michael, Yang, Xiaoyu

المصدر: Sci Data 8, 217 (2021)

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2103.02068

المؤلفون: Andersen, Casper W, Armiento, Rickard, Blokhin, Evgeny, Conduit, Gareth J, Dwaraknath, Shyam, Evans, Matthew L, Fekete, Ádám, Gopakumar, Abhijith, Gražulis, Saulius, Merkys, Andrius, Mohamed, Fawzi, Oses, Corey, Pizzi, Giovanni, Rignanese, Gian-Marco, Scheidgen, Markus, Talirz, Leopold, Toher, Cormac, Winston, Donald, Aversa, Rossella, Choudhary, Kamal, Colinet, Pauline, Curtarolo, Stefano, Di Stefano, Davide, Draxl, Claudia, Er, Suleyman, Esters, Marco, Fornari, Marco, Giantomassi, Matteo, Govoni, Marco, Hautier, Geoffroy, Hegde, Vinay, Horton, Matthew K, Huck, Patrick, Huhs, Georg, Hummelshøj, Jens, Kariryaa, Ankit, Kozinsky, Boris, Kumbhar, Snehal, Liu, Mohan, Marzari, Nicola, Morris, Andrew J, Mostofi, Arash A, Persson, Kristin A, Petretto, Guido, Purcell, Thomas, Ricci, Francesco, Rose, Frisco, Scheffler, Matthias, Speckhard, Daniel, Uhrin, Martin, Vaitkus, Antanas, Villars, Pierre, Waroquiers, David, Wolverton, Chris, Wu, Michael, Yang, Xiaoyu

المصدر: Scientific data. 8(1)

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/8d88v3s9

المؤلفون: Merkys, Andrius, Mounet, Nicolas, Cepellotti, Andrea, Marzari, Nicola, Gražulis, Saulius, Pizzi, Giovanni

المصدر: Journal of Cheminformatics 9, 56 (2017)

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/1706.08704

المؤلفون: Gražulis, Saulius^Aff3, Merkys, Andrius^Aff3, Vaitkus, Antanas^Aff3

المساهمون: Andreoni, Wanda, editor^Aff1, Yip, Sidney, editor^Aff2

المصدر: Handbook of Materials Modeling : Methods: Theory and Modeling. :1863-1881

المؤلفون: Smirnov, Alexey^Aff2, Manakova, Elena^Aff3, Gražulis, Saulius^Aff3, McKenna, Robert^Aff4, Matulis, Daumantas^Aff2

المساهمون: Matulis, Daumantas, editor^Aff1

المصدر: Carbonic Anhydrase as Drug Target : Thermodynamics and Structure of Inhibitor Binding. :179-202

المؤلفون: Zakšauskas, Audrius, Čapkauskaitė, Edita, Jezepčikas, Linas, Linkuvienė, Vaida, Paketurytė, Vaida, Smirnov, Alexey, Leitans, Janis, Kazaks, Andris, Dvinskis, Elviss, Manakova, Elena, Gražulis, Saulius, Tars, Kaspars, Matulis, Daumantas

المصدر: In European Journal of Medicinal Chemistry 1 January 2020 185