Neural network potentials for exploring condensed phase chemical reactivity by Gomez, Axel, de la Puente, Miguel, David, Rolf, Laage, Damien

Subjects: “…Chemical reactivity…”
Get full text

DFT and molecular docking analyses of the effects of solvent polarity and temperature on the structural, electronic, and thermodynamic properties of p-coumaric acid: Insights for a... by Umer Sherefedin, Abebe Belay, Kusse Gudishe, Alemu Kebede, Alemayehu Getahun Kumela, Tadesse Lemma Wakjira, Dereje Gelanu, Tesfaye Feyise, Jebel Haji Mahamud, Abdulkerim Abdela, Kebede Shankute Gizew

Subjects: Get full text

Process-based VOCs Source Profiles and Contributions to Ozone Formation in Typical Organic Solvent-used Industries in Hangzhou by Zhinian Li, Wenjuan Li, Rong Zhou, Xiaoping Miao, Jianhai Lu, Zhongren Wang, Zhongping Yang, Jian Wu

Subjects: Get full text