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GPUMD: A package for constructing accurate machine-learned potentials and performing highly efficient atomistic simulations
2天前
已完结
Mechanism for Unimolecular Decomposition of HMX (1,3,5,7-Tetranitro-1,3,5,7-tetrazocine), an ab Initio Study
6个月前
已完结
Trinitromethyl-Substituted 5-Nitro- or 3-Azo-1,2,4-triazoles: Synthesis, Characterization, and Energetic Properties
6个月前
已完结
A Study of Dinitro-bis-1,2,4-triazole-1,1′-diol and Derivatives: Design of High-Performance Insensitive Energetic Materials by the Introduction of N-Oxides
6个月前
已完结
Correlation of Drug Absorption with Molecular Surface Properties
6个月前
已完结
Prediction of Physicochemical Parameters by Atomic Contributions
6个月前
已关闭
Satisfying Hydrogen Bonding Potential in Proteins
7个月前
已完结
Statistical Mechanics: Theory and Molecular Simulation
7个月前
已完结
GPUMD: A package for constructing accurate machine-learned potentials and performing highly efficient atomistic simulations
7个月前
已完结
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