| Molecular, macromolecular, and supramolecular glucuronide prodrugs: Lead identified for anticancer prodrug monotherapy MT Jarlstad Olesen, R Walther, PP Poier, F Dagnæs‐Hansen, AN Zelikin Angewandte Chemie International Edition 59 (19), 7390-7396, 2020 | 37 | 2020 |
| Describing molecular polarizability by a bond capacity model PP Poier, F Jensen Journal of chemical theory and computation 15 (5), 3093-3107, 2019 | 27 | 2019 |
| Accurate deep learning-aided density-free strategy for many-body dispersion-corrected density functional theory PP Poier, T Jaffrelot Inizan, O Adjoua, L Lagardere, JP Piquemal The Journal of Physical Chemistry Letters 13 (19), 4381-4388, 2022 | 21 | 2022 |
| Molecular dynamics using nonvariational polarizable force fields: Theory, periodic boundary conditions implementation, and application to the bond capacity model PP Poier, L Lagardère, JP Piquemal, F Jensen Journal of Chemical Theory and Computation 15 (11), 6213-6224, 2019 | 19 | 2019 |
| Stochastic Evaluation of Many-Body van der Waals Energies in Large Complex Systems PP Poier, L Lagardere, JP Piquemal Journal of Chemical Theory and Computation 18 (3), 1633-1645, 2022 | 18 | 2022 |
| Generalized many-body dispersion correction through random-phase approximation for chemically accurate density functional theory PP Poier, O Adjoua, L Lagardère, JP Piquemal The Journal of Physical Chemistry Letters 14 (6), 1609-1617, 2023 | 10 | 2023 |
| Including implicit solvation in the bond capacity polarization model PP Poier, F Jensen The Journal of Chemical Physics 151 (11), 2019 | 10 | 2019 |
| Polarizable charges in a generalized Born reaction potential PP Poier, F Jensen The Journal of Chemical Physics 153 (2), 2020 | 8 | 2020 |
| Smooth particle mesh Ewald-integrated stochastic Lanczos many-body dispersion algorithm PP Poier, L Lagardère, JP Piquemal The Journal of Chemical Physics 159 (15), 2023 | 1 | 2023 |
| Variational formulation of the bond capacity charge polarization model PP Poier The Journal of Chemical Physics 156 (10), 2022 | 1 | 2022 |
| Calculating the energy profile of an enzymatic reaction on a quantum computer P Ettenhuber, MB Hansen, I Shaik, SE Rasmussen, PP Poier, NK Madsen, ... arXiv preprint arXiv:2408.11091, 2024 | | 2024 |
| Accurate Deep Learning-aided Density-free Strategy for Many-Body Dispersion-corrected DFT PP Poier, TJ Inizan, O Adjoua, L Lagardere, JP Piquemal arXiv preprint arXiv:2203.15739, 2022 | | 2022 |
| Formulation and Development of a Novel Bond Capacity Charge Polarization Model PP Poier | | 2020 |
| O (N) Stochastic Evaluation of Many-Body van der PP Poier, L Lagardere, JP Piquemal | | |
| Angewandte MJ Olesen, R Walther, P Poier, F Dagnæs-Hansen, AN Zelikin | | |
Louis LagardèreSorbonne Université在 sorbonne-universite.fr 的电子邮件经过验证
