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The Journal of Chemical Physics|September 10, 2018
The C(3P) + NO(X2Π) O(3P) + CN(X2Σ+), N(2D)/N(4S) + CO(X1Σ+) reaction: Rates, branching ratios, and final states from 15 K to 20 000 KDebasish Koner, Raymond J Bemish, Markus MeuwlyThe Journal of Physical Chemistry. B|November 27, 2020
Dynamics and Infrared Spectrocopy of Monomeric and Dimeric Wild Type and Mutant InsulinSeyedeh Maryam Salehi, Debasish Koner, Markus MeuwlyPhysical Chemistry Chemical Physics : PCCP|October 18, 2012
Structure, spectroscopy and dynamics of layered H2O and CO2 icesMyung Won Lee, Nuria Plattner, Markus MeuwlyJournal of Chemical Theory and Computation|November 8, 2022
Molecular Dynamics with Conformationally Dependent, Distributed ChargesEric D Boittier, Mike Devereux, Markus MeuwlyJournal of Computational Chemistry|May 2, 2024
Systematic improvement of empirical energy functions in the era of machine learningMike Devereux, Eric D Boittier, Markus MeuwlyPhysical Chemistry Chemical Physics : PCCP|June 29, 2018
From in silica to in silico: retention thermodynamics at solid-liquid interfacesKrystel El Hage, Raymond J Bemish, Markus MeuwlyBiophysical Journal|May 5, 2026
Tripeptide-Dynamics from Empirical and Machine-Learned Energy FunctionsSena Aydin, Valerii Andreichev, Pantelis Maragkoudakis, et al.Physical Chemistry Chemical Physics : PCCP|January 7, 2017
Reactive collisions for NO(2Π) + N(4S) at temperatures relevant to the hypersonic flight regimeOtoniel Denis-Alpizar, Raymond J Bemish, Markus MeuwlyThe Journal of Chemical Physics|December 2, 2025
Photodissociation dynamics of energized H2COO: Formation of molecular productsCangtao Yin, Silvan Käser, Meenu Upadhyay, et al.Journal of Chemical Theory and Computation|November 27, 2020
Polarizable Multipolar Molecular Dynamics Using Distributed Point ChargesMike Devereux, Marco Pezzella, Shampa Raghunathan, et al.Pageof 26