Zobrazeno 1 - 10
of 3 103
pro vyhledávání: '"An, Soojung"'
We introduce LiFlow, a generative framework to accelerate molecular dynamics (MD) simulations for crystalline materials that formulates the task as conditional generation of atomic displacements. The model uses flow matching, with a Propagator submod
Externí odkaz:
http://arxiv.org/abs/2410.01464
We study the regularity and the growth rates of solutions to two-dimensional Monge-Amp\`ere equations with the right-hand side exhibiting polynomial growth. Utilizing this analysis, we demonstrate that the translators for the flow by sub-affine-criti
Externí odkaz:
http://arxiv.org/abs/2404.01040
This paper shows the existence of convex translating surfaces under the flow by the $\alpha$-th power of Gauss curvature for the sub-affine-critical regime $ 0 < \alpha < 1/4$. The key aspect of our study is that our ansatz at infinity is the graph o
Externí odkaz:
http://arxiv.org/abs/2402.17075
In molecular dynamics simulations, rare events, such as protein folding, are typically studied using enhanced sampling techniques, most of which are based on the definition of a collective variable (CV) along which acceleration occurs. Obtaining an e
Externí odkaz:
http://arxiv.org/abs/2402.01542
Publikováno v:
Journal of Big Data, Vol 11, Iss 1, Pp 1-58 (2024)
Abstract Problem Attention deficit hyperactivity disorder (ADHD) is the most commonly found neurodevelopmental condition among children with an estimated 2.5% to 9% global prevalence. While ADHD has been regarded as a lifelong condition, its early di
Externí odkaz:
https://doaj.org/article/8b1c01b2f8704dcba8958a3fc30a1635
Coarse-graining (CG) accelerates molecular simulations of protein dynamics by simulating sets of atoms as singular beads. Backmapping is the opposite operation of bringing lost atomistic details back from the CG representation. While machine learning
Externí odkaz:
http://arxiv.org/abs/2303.01569
Autor:
Caroline McLaughlin, Qi Xiu Fu, Soojung Na, Matthew Heflin, Dongil Chung, Vincenzo G. Fiore, Xiaosi Gu
Publikováno v:
Communications Biology, Vol 7, Iss 1, Pp 1-11 (2024)
Abstract Social controllability, or the ability to exert control during social interactions, is crucial for optimal decision-making. Inability to do so might contribute to maladaptive behaviors such as smoking, which often takes place in social setti
Externí odkaz:
https://doaj.org/article/7f6e3524b54c4d13a876c25dfce0cf0c
Publikováno v:
Scientific Reports, Vol 14, Iss 1, Pp 1-11 (2024)
Abstract Microfluidic devices have immense potential for widespread community use, but a current bottleneck is the transition from research prototyping into mass production because the gold standard prototyping strategy is too costly and labor intens
Externí odkaz:
https://doaj.org/article/fa66157dd0c2420db825089748cffa65
Publikováno v:
BMC Public Health, Vol 24, Iss 1, Pp 1-11 (2024)
Abstract Background Vaccination is one of the greatest tools for individuals to stay healthy. Individuals are, however, often exposed to misinformation via digital and social media, and thus, may miss the opportunity to develop scientific knowledge a
Externí odkaz:
https://doaj.org/article/f25e5e1267004a4192fb8f19d2cd2948
Autor:
Hong, Soojung, Choi, Kwanghee
As maintaining road networks is labor-intensive, many automatic road extraction approaches have been introduced to solve this real-world problem, fueled by the abundance of large-scale high-resolution satellite imagery and advances in computer vision
Externí odkaz:
http://arxiv.org/abs/2211.06544