Generating Efficient Quantum Chemistry Codes for Novel Architectures von Titov, Alexey V, Ufimtsev, Ivan S, Luehr, Nathan, Martinez, Todd J

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TeraChem: A graphical processing unit‐accelerated electronic structure package for large‐scale ab initio molecular dynamics von Seritan, Stefan, Bannwarth, Christoph, Fales, Bryan S., Hohenstein, Edward G., Isborn, Christine M., Kokkila‐Schumacher, Sara I. L., Li, Xin, Liu, Fang, Luehr, Nathan, Snyder, James W., Song, Chenchen, Titov, Alexey V., Ufimtsev, Ivan S., Wang, Lee‐Ping, Martínez, Todd J.

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Sandwiched Graphene−Membrane Superstructures von Titov, Alexey V, Král, Petr, Pearson, Ryan

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TeraChem: Accelerating electronic structure and ab initio molecular dynamics with graphical processing units von Seritan, Stefan, Bannwarth, Christoph, Fales, B. Scott, Hohenstein, Edward G., Kokkila-Schumacher, Sara I. L., Luehr, Nathan, Snyder, James W., Song, Chenchen, Titov, Alexey V., Ufimtsev, Ivan S., Martínez, Todd J.

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Dipole−Dipole Interactions in Nanoparticle Superlattices von Talapin, Dmitri V, Shevchenko, Elena V, Murray, Christopher B, Titov, Alexey V, Král, Petr

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Modeling the Self-Assembly of Colloidal Nanorod Superlattices von Titov, Alexey V, Král, Petr

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Controllable Synthetic Molecular Channels: Biomimetic Ammonia Switch von Titov, Alexey V, Wang, Boyang, Sint, Kyaw, Král, Petr

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Transition metal and nitrogen doped carbon nanostructures von Stoyanov, Stanislav R., Titov, Alexey V., Král, Petr

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STATUS AND PERSPECTIVES OF E-NAVIGATION TECHNOLOGY IMPLEMENTATION von Titov, Alexey V., Barakat, Lama, Khaizaran, Anas

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TeraChem: Accelerating electronic structure and ab initio molecular dynamics with graphical processing units von Seritan, Stefan, Bannwarth, Christoph, Fales, B. Scott, Hohenstein, Edward G., Kokkila-Schumacher, Sara L., Luehr, Nathan, Snyder, James W., Song, Chenchen, Titov, Alexey V., Ufimtsev, Ivan S., Martínez, Todd J.

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Cover Image, Volume 11, Issue 2 von Seritan, Stefan, Bannwarth, Christoph, Fales, Bryan S., Hohenstein, Edward G., Isborn, Christine M., Kokkila‐Schumacher, Sara I. L., Li, Xin, Liu, Fang, Luehr, Nathan, Snyder, James W., Song, Chenchen, Titov, Alexey V., Ufimtsev, Ivan S., Wang, Lee‐Ping, Martínez, Todd J.

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TeraChem: A graphical processing unit-accelerated electronic structure package for large-scale ab initio molecular dynamics von Seritan, Stefan, Bannwarth, Christoph, Fales, Bryan S., Hohenstein, Edward G., Isborn, Christine M., Kokkila‐Schumacher, Sara L., Li, Xin, Liu, Fang, Luehr, Nathan, Snyder, James W., Song, Chenchen, Titov, Alexey V., Ufimtsev, Ivan S., Wang, Lee‐Ping, Martínez, Todd J.

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Study of the physicochemical and biological properties of the new promising Ti–20Nb–13Ta–5Zr alloy for biomedical applications von Konushkin, Sergey V., Sergiyenko, Konstantin V., Nasakina, Elena O., Leontyev, Vladimir G., Kuznetsova, Olga G., Titov, Dmitry D., Tsareva, Alena M., Dormidontov, Nikolay A., Kirsankin, Andrey A., Kannykin, Sergey V., Sevostyanov, Mikhail A., Kritskaya, Kristina A., Berezhnov, Alexey V., Laryushkin, Denis P., Kulikov, Alexander V., Belosludtsev, Konstantin N., Antipov, Sergey S., Volkov, Mikhail Yu, Kozlov, Valery A., Rebezov, Maksim B., Shikirin, Alexey V., Baimler, Ilya V., Simakin, Alexander V., Gudkov, Sergey V.

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Stress-controlled n–p conductivity switch based on intercalated ZrTe2 von Morozova, Natalia V., Korobeynikov, Igor V., Shkvarina, Elena G., Titov, Alexey A., Titov, Alexander N., Ovsyannikov, Sergey V.

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Concise and Free-Metal Access to Lactone-Annelated Pyrrolo[2,1- a ]isoquinoline Derivatives via a 1,2-Rearrangement Step von Obydennik, Arina Y, Titov, Alexander A, Listratova, Anna V, Borisova, Tatiana N, Rybakov, Victor B, Voskressensky, Leonid G, Varlamov, Alexey V

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Synthesis of Isomeric 3-Benzazecines Decorated with Endocyclic Allene Moiety and Exocyclic Conjugated Double Bond and Evaluation of Their Anticholinesterase Activity von Titov, Alexander A., Purgatorio, Rosa, Obydennik, Arina Y., Listratova, Anna V., Borisova, Tatiana N., de Candia, Modesto, Catto, Marco, Altomare, Cosimo D., Varlamov, Alexey V., Voskressensky, Leonid G.

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Advances in synthesis of novel annulated azecines and their unique pharmacological properties von Listratova, Anna V., Samarelli, Francesco, Titov, Alexander A., Purgatorio, Rosa, de Candia, Modesto, Catto, Marco, Varlamov, Alexey V., Voskressensky, Leonid G., Altomare, Cosimo D.

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Quaternary time scales for the Pontocaspian domain: Interbasinal connectivity and faunal evolution von Krijgsman, W., Tesakov, A., Yanina, T., Lazarev, S., Danukalova, G., Van Baak, C.G.C., Agustí, J., Alçiçek, M.C., Aliyeva, E., Bista, D., Bruch, A., Büyükmeriç, Y., Bukhsianidze, M., Flecker, R., Frolov, P., Hoyle, T.M., Jorissen, E.L., Kirscher, U., Koriche, S.A., Kroonenberg, S.B., Lordkipanidze, D., Oms, O., Rausch, L., Singarayer, J., Stoica, M., van de Velde, S., Titov, V.V., Wesselingh, F.P.

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Synthesis of 1-( para -methoxyphenyl)tetrazolyl-Substituted 1,2,3,4-Tetrahydroisoquinolines and Their Transformations Involving Activated Alkynes von Titov, Alexander A, Samavati, Reza, Alexandrova, Elena V, Borisova, Tatiana N, Dang Thi, Tuyet Anh, Nguyen, Van Tuyen, Le, Tuan Anh, Varlamov, Alexey V, Van der Eycken, Erik V, Voskressensky, Leonid G

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Pseudo Four-Component Synthesis of 5,6-Dihydroindolo[2,1‑a]isoquinolines von Miftyakhova, Almira R., Borisova, Tatiana N., Fakhrutdinov, Artem N., Ilyushenkova, Valentina V., Titov, Alexander A., Efimov, Ilya V., Tafeenko, Victor A., Varlamov, Alexey V., Voskressensky, Leonid G.

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