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Application

Discovery Studio 1.0 Materials Studio 0.945146894756415 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06377873200303107 Amorphous Cell 0.2769638797676181 Blends 0.0023995958575397827 CASTEP 0.3805253851982824 CDOCKER 0.1763071482697651 CHARMm 0.26521848951755495 COMPASS 0.36069714574387474 COMPASS III 0.08512250568325334 COSMObase 0.003788835564536499 COSMOconf 0.004294013639808032 COSMOmic 1.2629451881788332E-4 COSMOperm 0.0013892397069967164 COSMOplex 3.788835564536499E-4 COSMOquick 0.0010103561505430665 COSMOtherm 0.0650416771912099 Catalyst 0.11884314220762819 Classical Simulations 1.0 Conformers 5.051780752715333E-4 Crystallization 0.07375599898964386 DFTB Plus 0.006188431422076282 DMol3 0.17416014144986108 DPD 0.0030310684516291994 Discover 0.004294013639808032 Forcite 0.5255114928012125 GULP 0.02437484213185148 Kinetix 2.5258903763576663E-4 LUDI 0.004041424602172266 LibDock 0.07388229350846173 LigandFit 0.0055569588279868656 MCSS 5.051780752715333E-4 MODELER 0.20788077797423593 MesoDyn 0.0015155342258145997 Mesocite 0.004041424602172266 Mesoscale 0.007577671129072998 Modules 0.0 Morphology 0.017681232634503663 ONETEP 8.840616317251831E-4 Polymorph 0.0023995958575397827 QMERA 2.5258903763576663E-4 QSAR 0.0011366506693609498 Quantum Mechanics 0.5442030815862592 Reflex 0.05316999242232887 Reflex Plus 8.840616317251831E-4 Semi-empirical 0.008082849204344532 Sorption 0.05481182116696135 Synthia 0.0018944177822682495 TURBOMOLE 3.788835564536499E-4 VAMP 0.0013892397069967164 Visualization 0.8555190704723415 X-Cell 0.0011366506693609498 ZDOCK 0.030815862591563527

Year

2021 0.044461285840596186 2022 0.21119110774283187 2023 0.27169382341796133 2024 0.7905772388531009 2025 1.0 2026 0.5178729316660351 2027 0.0

Keywords

target 1.0 potential 0.2835152838427948 docking 0.2332423580786026 visualization 0.211353711790393 analysis 0.19716157205240176 between 0.15556768558951964 novel 0.10524017467248908 energy 0.08236899563318777 binding 0.08040393013100437 promising 0.06512008733624454 cell 0.06446506550218341 activity 0.06053493449781659 stability 0.03728165938864629 interaction 0.036026200873362446 synthesized 0.03460698689956332 experimental 0.02947598253275109 development 0.025600436681222707 performance 0.025218340611353713 protein 0.023307860262008734 effective 0.022161572052401747 mechanism 0.021779475982532753 including 0.019323144104803493 synthesis 0.01572052401746725 design 0.00480349344978166 silico 0.0
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