Results 31 to 40 of about 974,940 (289)
Analysis of molecular and (di)atomic dual-descriptor functions and matrices [PDF]
, 2021 In this work, the dual-descriptor is studied in matrix form f(2) (r, r') and both coordinates condensed to atoms, resulting in atomic and diatomic (or where applicable, bond) condensed single values. This double partitioning method of the dual-descriptor
Lain, Luis +4 more
core
mordred-descriptor/mordred: descriptor arithmetic
, 2017 new feature <ul> <li>issue doi using zenodo (fe8e2fe)</li> <li>descriptor arithmetic (7e10cb4)</li> <li>descriptor name dictionary (59a0e82)</li> </ul> broken changes <ul> <li>raise error when ...
philopon
core +1 more source
Pediatric Blood &Cancer, EarlyView.ABSTRACT Background Embryonal tumors comprise the majority of malignant central nervous system (CNS) neoplasms diagnosed in children under 3 years of age. Compared with their counterparts in older children, these tumors exhibit distinct molecular biology and a more aggressive clinical phenotype, while their management is complicated by the heightened ...
Sudarshawn Damodharan +3 more
wiley +1 more source
Dual descriptors within the framework of spin-polarized density functional theory
The Journal of Chemical Physics, 2008 Spin-polarized density functional theory (SP-DFT) allows both the analysis of charge-transfer (e.g., electrophilic and nucleophilic reactivity) and of spin-polarization processes (e.g., photophysical changes arising from electron transitions). In analogy with the dual descriptor introduced by Morell et al. [J. Phys. Chem.
Chamorro, Eduardo +4 more
openaire +7 more sources
Pediatric Blood &Cancer, EarlyView.ABSTRACT Background Survivorship care plans (SCPs) summarize cancer treatment and guide risk‐based follow‐up for cancer survivors, yet remain difficult to create, share, and use. Stakeholder perspectives are needed to inform usable approaches.
Molly S. Talman +4 more
wiley +1 more source
Journal of Cheminformatics, 2021 Enhanced/prolonged cAMP signalling has been suggested as a suppressor of cancer proliferation. Interestingly, two key modulators that elevate cAMP, the A2A receptor (A2AR) and phosphodiesterase 10A (PDE10A), are differentially co-expressed in various ...
Leen Kalash +7 more
doaj +1 more source
AI-Enhanced Digital Creativity Design: Content-Style Alignment for Image Stylization
IEEE Access, 2023 This paper presents an AI(Artificial Intelligence)-powered method for enhancing digital creative design through image stylization. To achieve this, we introduce the Content-Style Alignment Module (CSAM), which includes the Dual-Stream Content-Style ...
Lanting Yu, Qiang Zheng
doaj +1 more source
An overview of recent developments in computational methods for periodic systems [PDF]
, 2007 : At the First IFAC Workshop on Periodic Systems (Como, Italy, 2001), a state of the art survey of computational methods for periodic systems has been presented (Varga and Van Dooren, 2001).
Andras Varga, Varga, Andreas
core +1 more source
Therapeutic Apheresis and Dialysis, EarlyView.ABSTRACT Background Establishing a comprehensive apheresis medicine program in a resource‐constrained setting presents significant structural, financial, and logistical challenges. Despite the growing clinical importance of apheresis services globally, published experience from sub‐Saharan Africa remains sparse.
Folasade Adelekan‐Popoola +4 more
wiley +1 more source
Gut microbiome and aging—A dynamic interplay of microbes, metabolites, and the immune system
FEBS Letters, EarlyView.Age‐dependent shifts in microbial communities engender shifts in microbial metabolite profiles. These in turn drive shifts in barrier surface permeability of the gut and brain and induce immune activation. When paired with preexisting age‐related chronic inflammation this increases the risk of neuroinflammation and neurodegenerative diseases.
Aaron Mehl, Eran Blacher
wiley +1 more source