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1by Cárdenas, Gustavo, Lucia Tamudo, Jesús, Mateo de la Fuente, Henar, Palmisano, Vito F., Anguita Ortiz, Nuria, Ruano, Lorena, Pérez Barcia, Alvaro, Díaz-Tendero Victoria, Sergio, Mandado, Marcos, Nogueira Pérez, Juan JoséGet access
Published in Journal of Computational Chemistry (2022)
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3by Cárdenas, Gustavo, Lucia‐Tamudo, Jesús, Mateo‐delaFuente, Henar, Palmisano, Vito F., Anguita‐Ortiz, Nuria, Ruano, Lorena, Pérez‐Barcia, Álvaro, Díaz‐Tendero, Sergio, Mandado, Marcos, Nogueira, Juan J.Get access
Published in Journal of Computational Chemistry (2022)
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6by Parra Figueredo, José Gregorio, González, José, Perozo, Elizabeth, Iza, Peter“... of organic species using quantum-mechanical calculations to show undergraduate university students...”
Published in Educación Química (2023)
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7by Frenking, Gemot, Schmidt, Jochen, Schwarz, Helmut“...Abstract Extensive quantum mechanical calculations on the unrestricted MINDO/3 level reveal...”
Published in Zeitschrift für Naturforschung B (1982)
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9by Duván González (11362189), Luis Macaya (11362192), Esteban Vöhringer-Martinez (1760818)Subjects: “...molecular mechanics calculations...”
Published 2021
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10by Markić, Dario“.... Based on arbitrarily chosen tension field line, complete mechanical calculation has been revealed...”
Published 2015
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11by Figueiredo, Pedro, Almeida, Beatriz C., Dourado, Daniel F.A.R., Sousa, Andreia F., Silvestre, Armando J.D., Carvalho, Alexandra“... (CalB) by performing Quantum mechanics calculations and Quantum Mechanics/Molecular Mechanics Molecular...”
Published 2020
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12by Figueiredo, Pedro, Almeida, Beatriz C., Dourado, Daniel F.A.R., Sousa, Andreia F., Silvestre, Armando J.D., Carvalho, Alexandra“... (CalB) by performing Quantum mechanics calculations and Quantum Mechanics/Molecular Mechanics Molecular...”
Published 2019
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13“...Fatigue life predictions based on fracture mechanics calculations are required to satisfy...”
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14by Zaiguo Fu, Bo Yu, Yu Zhao, Yasuo Kawaguchi“... to further mechanical calculation and can provide references for risk evaluation and site management...”
Published in Advances in Mechanical Engineering (2014)
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15by Figueiredo, Pedro, Almeida, Beatriz C., Dourado, Daniel F.A.R., Sousa, Andreia F., Silvestre, Armando J.D., Carvalho, Alexandra“...;Candida antarctica</i> lipase B (CalB) by performing Quantum mechanics calculations and Quantum...”
Published 2020
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16by Fu, Zaiguo, Yu, Bo, Zhao, Yu, Kawaguchi, Yasuo“... to further mechanical calculation and can provide references for risk evaluation and site management...”
Published in Advances in Mechanical Engineering (2014)
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17“... celestial mechanics calculations. The present chapter reviews three essential elements of any astronomical...”
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18“... celestial mechanics calculations. The present chapter reviews three essential elements of any astronomical...”
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19“...-mechanical calculations of the CNDO/INDO type to investigate the energetics of a gas-phase molecule...”
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20“... evolutionary searches combined with quantum-mechanical calculations, we explore the C-H-O system at pressures...”
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