日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

Mantle heterogeneity influenced Earth's ancient magnetic field

地幔非均质性影响了地球的远古磁场。

Biggin, A J; Davies, C J; Mound, J E; Lloyd, S J; Engbers, Y E; Thallner, D; Clarke, A T; Bono, R K

Developments and challenges in hit progression within fragment-based drug discovery

基于片段的药物发现中先导化合物筛选进展及挑战

Grosjean, Harold; Biggin, Philip C

Structural basis for domain coupling in heteromeric glycine receptors revealed by an atypical allosteric agonist

非典型变构激动剂揭示异源甘氨酸受体中结构域偶联的结构基础

Gibbs, Eric; Feddersen, Bjarne; Kindig, Kayla J; Seiferth, David; Biggin, Philip C; Chakrapani, Sudha

Structural determinants for GPCR-mediated inhibition of TASK K2P channels by diacylglycerol and its dysfunction in disease

二酰甘油通过GPCR介导抑制TASK K2P通道的结构决定因素及其在疾病中的功能障碍

Jouen-Tachoire, Thibault R H; Proks, Peter; Seiferth, David; Crowther, Kate; Biggin, Philip C; Baukrowitz, Thomas; Schewe, Marcus; Tucker, Stephen J

Structure-activity relationships can be directly extracted from high-throughput crystallographic evaluation of fragment elaborations in crude reaction mixtures

结构-活性关系可以直接从粗反应混合物中片段衍生化的高通量晶体学评价中提取出来。

Grosjean, Harold; Fieseler, Kate K; Sanchez-Garcia, Rubén; Thompson, Warren; Deane, Charlotte M; von Delft, Frank; Biggin, Philip C

Mobility and strength training with and without protein supplements for pre-frail/frail older people with low protein intake: maximising mobility and strength training (MMoST) feasibility randomised controlled trial

针对低蛋白摄入的衰弱前期/衰弱老年人,补充和不补充蛋白质进行活动能力和力量训练:最大化活动能力和力量训练(MMoST)可行性随机对照试验

Williamson, Esther; Biggin, Kavita; Morris, Alana; Marian, Ioana R; Mwema, Christopher; Carver, Andrew; Lamb, Sarah Elizabeth

The need to implement FAIR principles in biomolecular simulations

在生物分子模拟中实施 FAIR 原则的必要性

Amaro, Rommie E; Åqvist, Johan; Bahar, Ivet; Battistini, Federica; Bellaiche, Adam; Beltran, Daniel; Biggin, Philip C; Bonomi, Massimiliano; Bowman, Gregory R; Bryce, Richard A; Bussi, Giovanni; Carloni, Paolo; Case, David A; Cavalli, Andrea; Chang, Chia-En A; Cheatham, Thomas E 3rd; Cheung, Margaret S; Chipot, Christophe; Chong, Lillian T; Choudhary, Preeti; Cisneros, G Andres; Clementi, Cecilia; Collepardo-Guevara, Rosana; Coveney, Peter; Covino, Roberto; Crawford, T Daniel; Dal Peraro, Matteo; de Groot, Bert L; Delemotte, Lucie; De Vivo, Marco; Essex, Jonathan W; Fraternali, Franca; Gao, Jiali; Gelpí, Josep Ll; Gervasio, Francesco L; González-Nilo, Fernando D; Grubmüller, Helmut; Guenza, Marina G; Guzman, Horacio V; Harris, Sarah; Head-Gordon, Teresa; Hernandez, Rigoberto; Hospital, Adam; Huang, Niu; Huang, Xuhui; Hummer, Gerhard; Iglesias-Fernández, Javier; Jensen, Jan H; Jha, Shantenu; Jiao, Wanting; Jorgensen, William L; Kamerlin, Shina C L; Khalid, Syma; Laughton, Charles; Levitt, Michael; Limongelli, Vittorio; Lindahl, Erik; Lindorff-Larsen, Kresten; Loverde, Sharon; Lundborg, Magnus; Luo, Yun L; Luque, F Javier; Lynch, Charlotte I; MacKerell, Alexander D Jr; Magistrato, Alessandra; Marrink, Siewert J; Martin, Hugh; McCammon, J Andrew; Merz, Kenneth; Moliner, Vicent; Mulholland, Adrian J; Murad, Sohail; Naganathan, Athi N; Nangia, Shikha; Noe, Frank; Noy, Agnes; Oláh, Julianna; O'Mara, Megan L; Ondrechen, Mary Jo; Onuchic, Jose N; Onufriev, Alexey; Osuna, Sílvia; Palermo, Giulia; Panchenko, Anna R; Pantano, Sergio; Parish, Carol; Parrinello, Michele; Perez, Alberto; Perez-Acle, Tomas; Perilla, Juan R; Pettitt, B Montgomery; Pietropaolo, Adriana; Piquemal, Jean-Philip; Poma, Adolfo B; Praprotnik, Matej; Ramos, Maria J; Ren, Pengyu; Reuter, Nathalie; Roitberg, Adrian; Rosta, Edina; Rovira, Carme; Roux, Benoit; Rothlisberger, Ursula; Sanbonmatsu, Karissa Y; Schlick, Tamar; Shaytan, Alexey K; Simmerling, Carlos; Smith, Jeremy C; Sugita, Yuji; Świderek, Katarzyna; Taiji, Makoto; Tao, Peng; Tieleman, D Peter; Tikhonova, Irina G; Tirado-Rives, Julian; Tuñón, Iñaki; van der Kamp, Marc W; van der Spoel, David; Velankar, Sameer; Voth, Gregory A; Wade, Rebecca; Warshel, Ariel; Welborn, Valerie Vaissier; Wetmore, Stacey D; Wheeler, Travis J; Wong, Chung F; Yang, Lee-Wei; Zacharias, Martin; Orozco, Modesto

Binding-Site Purification of Actives (B-SPA) Enables Efficient Large-Scale Progression of Fragment Hits by Combining Multi-Step Array Synthesis With HT Crystallography

结合位点活性化合物纯化(B-SPA)结合多步阵列合成和高通量晶体学,可实现片段先导化合物的高效大规模筛选。

Grosjean, Harold; Aimon, Anthony; Hassell-Hart, Storm; Thompson, Warren; Koekemoer, Lizbé; Bennett, James; Bradley, Anthony; Anderson, Cameron; Wild, Conor; Bradshaw, William J; FitzGerald, Edward A; Krojer, Tobias; Fedorov, Oleg; Biggin, Philip C; Spencer, John; von Delft, Frank

Asymmetric gating of a homopentameric ion channel GLIC revealed by cryo-EM

冷冻电镜揭示同源五聚体离子通道GLIC的不对称门控

Li, Zhuowen; Bharambe, Nikhil; Manishrao Lande, Kashmiri; Feddersen, Bjarne; Manikkoth Balakrishna, Asha; Biggin, Philip C; Sahu, Giriraj; Basak, Sandip

Narrowing the gap between machine learning scoring functions and free energy perturbation using augmented data

利用增强数据缩小机器学习评分函数与自由能扰动之间的差距

Valsson, Ísak; Warren, Matthew T; Deane, Charlotte M; Magarkar, Aniket; Morris, Garrett M; Biggin, Philip C