검색결과 : 3건
No. | Article |
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1 |
Can One Trust Kinetic and Thermodynamic Observables from Biased Metadynamics Simulations?: Detailed Quantitative Benchmarks on Millimolar Drug Fragment Dissociation Pramanik D, Smith Z, Kells A, Tiwary P Journal of Physical Chemistry B, 123(17), 3672, 2019 |
2 |
Calculating Kinetic Rates and Membrane Permeability from Biased Simulations Badaoui M, Kells A, Molteni C, Dickson CJ, Hornak V, Rosta E Journal of Physical Chemistry B, 122(49), 11571, 2018 |
3 |
Fuel cell hybrid taxi life cycle analysis Baptista P, Ribau J, Bravo J, Silva C, Adcock P, Kells A Energy Policy, 39(9), 4683, 2011 |