| Molecular dynamics simulations in drug discovery and pharmaceutical development OMH Salo-Ahen, I Alanko, R Bhadane, AMJJ Bonvin, RV Honorato, ... Processes 9 (1), 71, 2020 | 231 | 2020 |
| Tracking Dehydration Mechanisms in Crystalline Hydrates with Molecular Dynamics Simulations AS Larsen, MT Ruggiero, KE Johansson, JA Zeitler, J Rantanen Crystal Growth & Design, 2017 | 34 | 2017 |
| Determining short-lived solid forms during phase transformations using molecular dynamics AS Larsen, MA Olsen, H Moustafa, FH Larsen, SPA Sauer, J Rantanen, ... CrystEngComm 21 (27), 4020-4024, 2019 | 18 | 2019 |
| Computational Dehydration of Crystalline Hydrates Using Molecular Dynamics Simulations AS Larsen, K E. Johansson, J Rantanen Journal of Pharmaceutical Sciences 106 (1), 348-355, 2017 | 17 | 2017 |
| ProCS15: a DFT-based chemical shift predictor for backbone and Cβ atoms in proteins AS Larsen, LA Bratholm, AS Christensen, M Channir, JH Jensen PeerJ 3, e1344, 2015 | 16 | 2015 |
| Molecular dynamics simulations in drug discovery and pharmaceutical development. Processes. 2020; 9 (1): 71 OMH Salo-Ahen, I Alanko, R Bhadane, A Bonvin, RV Honorato, ... | 14 | |
| Effect of pH on the Surface Layer of Molecular Crystals at the Solid–Liquid Interface M Herzberg, AS Larsen, T Hassenkam, AØ Madsen, J Rantanen Molecular Pharmaceutics 19 (5), 1598-1603, 2022 | 2 | 2022 |
| In situ nanoscale visualization of solvent effects on molecular crystal surfaces M Herzberg, AS Larsen, T Hassenkam, AØ Madsen, J Rantanen CrystEngComm 23 (16), 2933-2937, 2021 | 2 | 2021 |
| Unveiling polyamorphism and polyamorphic interconversions in pharmaceuticals: the peculiar case of hydrochlorothiazide ICB Martins, AS Larsen, AØ Madsen, OA Frederiksen, A Correia, ... Chemical Science 14 (41), 11447-11455, 2023 | 1 | 2023 |
| Protein Chemical Shift Prediction AS Larsen arXiv preprint arXiv:1409.6772, 2014 | 1 | 2014 |
| PhAI: A deep learning approach to solve the crystallographic phase problem AS Larsen, T Rekis, AØ Madsen | | 2023 |
| The structure of magnesium stearate trihydrate determined from a micrometre-sized single crystal using a microfocused synchrotron X-ray beam M Herzberg, T Rekis, A Støttrup Larsen, A Gonzalez, J Rantanen, ... Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2023 | | 2023 |
| MS35-1-1 Data-driven approach for the solution of the phase problem in crystallography: first insights# MS35-1-1 T Rekis, AS Larsen, AØ Madsen Foundations of Crystallography 78, e737, 2022 | | 2022 |
| Molecular dynamics simulations in drug discovery and pharmaceutical development. Processes 9: 71 OMH Salo-Ahen, I Alanko, R Bhadane, A Bonvin, RV Honorato, ... | | 2021 |
| Molecular Dynamics Simulations in Drug Discovery and Pharmaceutical Development. Processes 2021, 9, 71 OMH Salo-Ahen, I Alanko, R Bhadane, A Bonvin, RV Honorato, ... s Note: MDPI stays neu-tral with regard to jurisdictional clai-ms in …, 2020 | | 2020 |
| MS35-O4 Computational dehydration of an organic hydrate using molecular dynamics simulations AS Larsen, J van de Streek, J Rantanen, KE Johansson Foundations of Crystallography 72, s129, 2016 | | 2016 |
Lars Andersen BratholmUniversity of BristolVerified email at bristol.ac.uk
