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论文共 263 篇作者统计合作学者相似作者

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Multiobjective Evolutionary Strategy for Improving Semiempirical Hamiltonians in the Study of Enzymatic Reactions at the QM/MM Level of Theory
José Luís Velázquez-Libera, Rodrigo Recabarren,Esteban Vöhringer-Martinez, Yamisleydi Salgueiro,J Javier Ruiz-Pernía,Julio Caballero,Iñaki Tuñón
Journal of chemical theory and computationno. 10 (2025): 5118-5131
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The Need to Implement FAIR Principles in Biomolecular Simulations
Rommie E Amaro,Johan Åqvist,Ivet Bahar,Federica Battistini, Adam Bellaiche,Daniel Beltran,Philip C Biggin,Massimiliano Bonomi,Gregory R Bowman,Richard A Bryce,Giovanni Bussi,Paolo Carloni,David A Case,Andrea Cavalli,Chia-En A Chang,Thomas E Cheatham,Margaret S Cheung,Christophe Chipot,Lillian T Chong, Preeti Choudhary,G Andres Cisneros,Cecilia Clementi,Rosana Collepardo-Guevara,Peter Coveney,Roberto Covino,T Daniel Crawford,Matteo Dal Peraro,Bert L de Groot,Lucie Delemotte,Marco De Vivo,Jonathan W Essex,Franca Fraternali,Jiali Gao,Josep Ll Gelpí,Francesco L Gervasio,Fernando D González-Nilo, Helmut Grubmüller, Marina G Guenza,Horacio V Guzman,Sarah Harris,Teresa Head-Gordon,Rigoberto Hernandez,Adam Hospital,Niu Huang,Xuhui Huang,Gerhard Hummer,Javier Iglesias-Fernández,Jan H Jensen,Shantenu Jha,Wanting Jiao,William L Jorgensen,Shina C L Kamerlin,Syma Khalid,Charles Laughton,Michael Levitt,Vittorio Limongelli,Erik Lindahl,Kresten Lindorff-Larsen, Sharon Loverde,Magnus Lundborg, Yun L Luo,F Javier Luque, Charlotte I Lynch,Alexander D MacKerell,Alessandra Magistrato,Siewert J Marrink, Hugh Martin,J Andrew McCammon,Kenneth Merz,Vicent Moliner,Adrian J Mulholland, Sohail Murad,Athi N Naganathan,Shikha Nangia,Frank Noe,Agnes Noy,Julianna Oláh,Megan L O'Mara,Mary Jo Ondrechen,Jose N Onuchic,Alexey Onufriev,Sílvia Osuna,Giulia Palermo,Anna R Panchenko,Sergio Pantano, Carol Parish,Michele Parrinello,Alberto Perez,Tomas Perez-Acle,Juan R Perilla,B Montgomery Pettitt,Adriana Pietropaolo,Jean-Philip Piquemal, Adolfo B Poma,Matej Praprotnik,Maria J Ramos,Pengyu Ren,Nathalie Reuter,Adrian Roitberg,Edina Rosta, Carme Rovira,Benoit Roux,Ursula Rothlisberger,Karissa Y Sanbonmatsu,Tamar Schlick,Alexey K Shaytan,Carlos Simmerling,Jeremy C Smith,Yuji Sugita,Katarzyna Świderek,Makoto Taiji,Peng Tao,D Peter Tieleman,Irina G Tikhonova,Julian Tirado-Rives,Iñaki Tuñón,Marc W van der Kamp,David van der Spoel,Sameer Velankar,Gregory A Voth,Rebecca Wade, Ariel Warshel,Valerie Vaissier Welborn,Stacey D Wetmore,Travis J Wheeler,Chung F Wong,Lee-Wei Yang,Martin Zacharias,Modesto Orozco
Nature methodsno. 4 (2025): 641-645
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DNA Triplet Energies by Free Energy Perturbation Theory
Rafael Garcia-Messeguer,Miriam Navarrete-Miguel,Sergio Marti,Inaki Tunon,Daniel Roca-Sanjuan
JOURNAL OF CHEMICAL THEORY AND COMPUTATIONno. 3 (2025): 1353-1359
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Mechanistic Insights into GTP Hydrolysis by the RhoA Protein: Catalytic Impact of Glutamine Tautomerism
Jorge Pardos, Adrián García-Martínez,J Javier Ruiz-Pernía,Iñaki Tuñón
ACS catalysisno. 6 (2025): 4415-4428
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作者统计

#Papers: 263

#Citation: 8216

H-Index: 50

G-Index: 78

Sociability: 6

Diversity: 3

Activity: 36

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