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41


Journal Article
Biological chemistry, 402 (2021) 9, S. 1047-1062
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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Journal Article
Structure, 29 (2021) 10, S. 1144-1155.e5
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2021-06-08. Available in OpenAccess from 2022-06-08. 
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43


Journal Article
International journal of molecular sciences, 22 (2021) 19, S. 10345 -
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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44


Journal Article
Viruses, 13 (2021) 3, S. 504
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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45


Journal Article
Journal of chemical information and modeling, 61 (2021) 2, S. 548–553
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2021-01-19. Available in OpenAccess from 2022-01-19.  Restricted 
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46


Journal Article
Journal of chemical information and modeling, 61 (2021) 8, S. 4023–4030
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2021-08-09. Available in OpenAccess from 2022-08-09. 
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47


Journal Article
Journal of chemical theory and computation, 17 (2021) 7, S. 4599–4613
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Get full text  Published on 2021-06-23. Available in OpenAccess from 2022-06-23. 
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48


Journal Article
Biophysical journal, 120 (2021) 5, S. 950-963
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Restricted  Published on 2021-01-28. Available in OpenAccess from 2022-01-28. 
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49


Journal Article
The journal of chemical physics, 154 (2021) 10, S. 109901 -
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2021-03-10. Available in OpenAccess from 2022-03-10.  Published on 2021-03-10. Available in OpenAccess from 2022-03-10. 
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50


Journal Article
Science advances, 7 (2021) 37, S. eabg4298
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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51


Journal Article
Biological chemistry, 402 (2021) 3, S. 317–331
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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52


Journal Article
Chemical research in toxicology, 34 (2021) 6, S. 1503–1517
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Restricted  Published on 2021-04-26. Available in OpenAccess from 2022-04-26. 
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53


Journal Article
Computational and structural biotechnology journal, 19 (2021) S. 743-751
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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54


Journal Article
Molecules, 26 (2021) 4, S. 995 -
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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55


Journal Article
Journal of chemical theory and computation, 17 (2021) 11, S. 7281 - 7289
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Get full text  Published on 2021-10-18. Available in OpenAccess from 2022-10-18. 
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56


Journal Article
Journal of chemical information and modeling, 61 (2021) 11, S. 5626–5643
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Get full text  Published on 2021-11-08. Available in OpenAccess from 2022-11-08. 
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57


Journal Article
Proceedings of the National Academy of Sciences of the United States of America, 118 (2021) 30, S. e2100469118
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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58


Journal Article
Computational and structural biotechnology journal, 19 (2021) S. 4248-4264
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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59


Journal Article
The Journal of Chemical Physics The journal of chemical physics, 152 152 (2020 2020) 22 22, S. 221103 221103
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2020-06-12. Available in OpenAccess from 2021-06-12.  Published on 2020-06-12. Available in OpenAccess from 2021-06-12.  Published on 2020-06-12. Available in OpenAccess from 2021-06-12.  Published on 2020-06-12. Available in OpenAccess from 2021-06-12. 
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60


Journal Article
Chemical communications, 56 (2020) S. 7589-7592
“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Get full text  Published on 2020-06-01. Available in OpenAccess from 2021-06-01.  Published on 2020-06-01. Available in OpenAccess from 2021-06-01.  Get full text 
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Forschergruppe Gohlke 106 Computational Science and Mathematical Methods 66 Domain-Specific Simulation & Data Life Cycle Labs (SDLs) and Research Groups 57 Biological and environmental resources for sustainable use 47 Utilization of renewable carbon and energy sources and engineering of ecosystem functions 24 Molecular Information Processing in Cellular Systems 22 more ...