受强制性开放获取政策约束的文章 - Brandon Duane Walker了解详情
可在其他位置公开访问的文章：13 篇
Polarizable force fields for biomolecular simulations: Recent advances and applications
Z Jing, C Liu, SY Cheng, R Qi, BD Walker, JP Piquemal, P Ren
Annual Review of biophysics 48 (1), 371-394, 2019
强制性开放获取政策： US National Institutes of Health
Automation of AMOEBA polarizable force field for small molecules: Poltype 2
B Walker, C Liu, E Wait, P Ren
Journal of computational chemistry 43 (23), 1530-1542, 2022
强制性开放获取政策： US National Science Foundation, US National Institutes of Health, Cancer …
Recent progress in general force fields of small molecules
X He, B Walker, VH Man, P Ren, J Wang
Current opinion in structural biology 72, 187-193, 2022
强制性开放获取政策： US National Science Foundation, US National Institutes of Health
Implicit solvents for the polarizable atomic multipole AMOEBA force field
RA Corrigan, G Qi, AC Thiel, JR Lynn, BD Walker, TL Casavant, ...
Journal of chemical theory and computation 17 (4), 2323-2341, 2021
强制性开放获取政策： US National Science Foundation, US National Institutes of Health, European …
E2edna: Simulation protocol for dna aptamers with ligands
M Kilgour, T Liu, BD Walker, P Ren, L Simine
Journal of chemical information and modeling 61 (9), 4139-4144, 2021
强制性开放获取政策： US National Institutes of Health, Natural Sciences and Engineering Research …
Molecular dynamics free energy simulations of ATP:Mg2+ and ADP:Mg2+ using the polarisable force field AMOEBA
B Walker, Z Jing, P Ren
Molecular simulation 47 (5), 439-448, 2021
强制性开放获取政策： US National Science Foundation, US National Institutes of Health
Accurate description of molecular dipole surface with charge flux implemented for molecular mechanics
X Yang, C Liu, BD Walker, P Ren
The Journal of Chemical Physics 153 (6), 2020
强制性开放获取政策： US National Science Foundation, US National Institutes of Health, Cancer …
Computational and experimental studies of inhibitor Design for Aldolase A
R Qi, B Walker, Z Jing, M Yu, G Stancu, R Edupuganti, KN Dalby, P Ren
The Journal of Physical Chemistry B 123 (28), 6034-6041, 2019
强制性开放获取政策： US National Institutes of Health, Cancer Prevention Research Institute of …
Computational insights into the binding of IN17 inhibitors to MELK
M Harger, JH Lee, B Walker, JM Taliaferro, R Edupuganti, KN Dalby, ...
Journal of molecular modeling 25, 1-10, 2019
强制性开放获取政策： US National Institutes of Health, Cancer Prevention Research Institute of …
An efficient approach to large-scale ab initio conformational energy profiles of small molecules
Y Wang, BD Walker, C Liu, P Ren
Molecules 27 (23), 8567, 2022
强制性开放获取政策： US National Institutes of Health
Molecular Dynamics and Free Energy Calculations of Dicyclohexano-18-crown-6 Diastereoisomers with Sm2+, Eu2+, Dy2+, Yb2+, Cf2+, and Three Halide Salts …
H Arabzadeh, B Walker, JM Sperling, O Acevedo, P Ren, W Yang, ...
The Journal of Physical Chemistry B 126 (50), 10721-10731, 2022
强制性开放获取政策： US Department of Energy, US National Institutes of Health
Histidine 73 methylation coordinates β-actin plasticity in response to key environmental factors
A Schahl, L Lagardere, B Walker, P Ren, H Wioland, M Ballet, A Jégou, ...
bioRxiv, 2022.12. 16.520803, 2022
强制性开放获取政策： European Commission
β-actin plasticity is modulated by coordinated actions of histidine 73 methylation, nucleotide type, and ions
A Schahl, L Lagardere, B Walker, P Ren, A Jégou, M Chavent, J Piquemal
强制性开放获取政策： European Commission
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