Meeting Abstract (35)
601.
Meeting Abstract
258, 105-COMP. ACS Fall National Meeting and Exposition, San Diego, CA, 25. August 2019 - 29. August 2019. (2019)
High-throughput molecular dynamics of drug-membrane thermodynamics. In Abstracts of Papers of the American Chemical Society, 602.
Meeting Abstract
257, 632. National Meeting of the American-Chemical-Society (ACS), Orlando, FL, USA, 31. März 2019 - 04. April 2019. ACS, Washington DC, USA (2019)
Aromatic molecules at ice surfaces: solvation and light absorption. In Abstracts of Papers of the American Chemical Society, 603.
Meeting Abstract
257, 37. National Meeting of the American-Chemical-Society (ACS), Orlando, FL, 31. März 2019 - 04. April 2019. (2019)
Smart polymers in miscible solvent mixtures in bulk and at interfaces. In Abstracts of Papers of the American Chemical Society, 604.
Meeting Abstract
116 (3), 1436-Pos, S. 291A - 291A. 63rd Annual Meeting of the Biophysical-Society, Baltimore, MD, 02. März 2019 - 06. März 2019. Cell Press, Cambridge, Mass. (2019)
Implicit Solvent Calculations at Large-Scale Virus-Level Poisson-Boltzmann and Multiscale Simulations for Electrostatics. In Biophysical Journal, 605.
Meeting Abstract
116 (3), 1567-Plat, S. 318A - 318A. 63rd Annual Meeting of the Biophysical-Society, Baltimore, MD, 02. März 2019 - 06. März 2019. Cell Press, Cambridge, Mass. (2019)
Investigating Drug-Membrane Permeability across Chemical Compound Space using High-Throughput Coarse-Grained Simulations. In Biophysical Journal, 606.
Meeting Abstract
258, 616-COLL. ACS Fall National Meeting and Exposition, San Diego, CA, 25. August 2019 - 29. August 2019. (2019)
Understanding interfacial interactions to unlock the potential of bioinspired nanomaterials. In Abstracts of Papers of the American Chemical Society, 607.
Meeting Abstract
258, 22-COMP. ACS Fall National Meeting and Exposition, San Diego, CA, 25. August 2019 - 29. August 2019. (2019)
Consistent representation of structural and dynamical properties from coarse-grained simulation models. In Abstracts of Papers of the American Chemical Society, 608.
Meeting Abstract
257, 88. National Meeting of the American-Chemical-Society (ACS), Orlando, FL, USA, 31. März 2019 - 04. April 2019. ACS, Washington DC, USA (2019)
Recent developments and applications of variationally enhanced sampling. In Abstracts of Papers of the American Chemical Society, 609.
Meeting Abstract
114 (3), 2754-Plat, S. 557A - 557A. 62nd Annual Meeting of the Biophysical-Society, San Francisco, CA, 17. Februar 2018 - 21. Februar 2018. Cell Press, Cambridge, Mass. (2018)
Computational High-throughput Screening of Drug-Membrane Thermodynamics. In Biophysical Journal, 610.
Meeting Abstract
255, 248. 255th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nexus of Food, Energy, and Water, New Orleans, LA, 18. März 2018 - 22. März 2018. (2018)
Molecular-level order, disorder, and interactions in conjugated polymers and blends from solid-state NMR. In Abstracts of Papers of the American Chemical Society, 611.
Meeting Abstract
Temperature dependence of persistence length affects top-down descriptions of aligning interactions in nematic conjugated polymers. In Abstracts of Papers of the American Chemical Society, (256), 622. 256th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nanoscience, Nanotechnology and Beyond, Boston, MA, 19. August 2018 - 23. August 2018. (2018)
612.
Meeting Abstract
112 (3), 689-Pos, S. 140A - 140A. 61st Annual Meeting of the Biophysical-Society, New Orleans, LA, 11. Februar 2017 - 15. Februar 2017. Cell Press, Cambridge, Mass. (2017)
High-Throughput Thermodynamics of Drug-Membrane Interactions from Multiscale Simulations. In Biophysical Journal, 613.
Meeting Abstract
112 (3), 958-Pos, S. 194A - 194A . 61st Annual Meeting of the Biophysical-Society, New Orleans, LA, 11. Februar 2017 - 15. Februar 2017. Cell Press, Cambridge, Mass. (2017)
Characterization of Coarse-Grained Helix-Coil Transition Kinetics using Markov State Models. In Biophysical Journal, 614.
Meeting Abstract
253, 134. 253rd National Meeting of the American-Chemical-Society (ACS) on Advanced Materials, Technologies, Systems, and Processes, San Francisco, CA, 30. März 2017 - 07. April 2017. (2017)
Building Markov state models of diffusion processes in many-particle systems from generic order parameters. In Abstracts of Papers of the American Chemical Society, 615.
Meeting Abstract
110 (3), S. 643A - 643A . Cell Press, Cambridge, Mass. (2016)
On the Effect of Mapping in the Coarse Graining of Elastic Networks. In Biophysical Journal, 616.
Meeting Abstract
251, 45. 251st National Meeting of the American-Chemical-Society (ACS), San Diego, CA, 10. März 2016 - 18. März 2016. (2016)
Multiscale simulations for soft matter: Recent developments and applications. In Abstracts of Papers of the American Chemical Society, 617.
Meeting Abstract
110 (3), S. 523A - 523A . Cell Press, Cambridge, Mass. (2016)
Improved Kinetics of Molecular Simulations using Biased Markov State Models. In Biophysical Journal, 618.
Meeting Abstract
108 (2), 1251-Pos, S. 247A - 248A . Cell Press, Cambridge, Mass. (2015)
Transmembrane-Peptide Structure Formation from Coarse-Grained Simulations. In Biophysical Journal, 619.
Meeting Abstract
249, 297. 249th National Meeting of the American-Chemical-Society (ACS), Denver, CO, 20. März 2015 - 27. März 2015. (2015)
Relative resolution: A hybrid strategy for molecular modeling. In Abstracts of Papers of the American Chemical Society, 620.
Meeting Abstract
108 (2), 809-Pos, S. 161A - 161A . Cell Press, Cambridge, Mass. (2015)
Investigation of a Method to Efficiently Create Elastic Networks. In Biophysical Journal,