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Application

Discovery Studio 1.0 Materials Studio 0.9739521353960069 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.061394728061394725 Amorphous Cell 0.2784451117784451 Blends 0.002002002002002002 CASTEP 0.3383383383383383 CDOCKER 0.16966966966966968 CHARMm 0.27177177177177175 COMPASS 0.3421755088421755 COMPASS III 0.0990990990990991 COSMObase 0.004337671004337671 COSMOconf 0.005672339005672339 COSMOmic 0.0 COSMOperm 5.005005005005005E-4 COSMOplex 1.668335001668335E-4 COSMOquick 0.001334668001334668 COSMOtherm 0.06306306306306306 Catalyst 0.09259259259259259 Classical Simulations 1.0 Conformers 3.33667000333667E-4 Crystallization 0.0702369035702369 DFTB Plus 0.004170837504170837 DMol3 0.1519853186519853 DPD 0.0021688355021688356 Discover 0.0035035035035035035 Forcite 0.5256923590256923 GULP 0.01901901901901902 Kinetix 1.668335001668335E-4 LUDI 0.0035035035035035035 LibDock 0.07190523857190524 LigandFit 0.004170837504170837 MCSS 5.005005005005005E-4 MODELER 0.25675675675675674 MesoDyn 6.67334000667334E-4 Mesocite 0.0031698365031698366 Mesoscale 0.005672339005672339 Modules 0.0 Morphology 0.01568234901568235 ONETEP 8.341675008341675E-4 Polymorph 0.0018351685018351686 QMERA 1.668335001668335E-4 QSAR 5.005005005005005E-4 Quantum Mechanics 0.4811478144811478 Reflex 0.05138471805138472 Reflex Plus 0.001001001001001001 Semi-empirical 0.005672339005672339 Sorption 0.055221888555221886 Synthia 0.001001001001001001 TURBOMOLE 3.33667000333667E-4 VAMP 0.001001001001001001 Visualization 0.7392392392392393 X-Cell 0.0015015015015015015 ZDOCK 0.02952952952952953

Year

2023 0.02168418251962219 2024 0.5516828522016762 2025 1.0 2026 0.5648529998669682 2027 0.0

Keywords

target 1.0 potential 0.3016541822721598 docking 0.22448501872659177 analysis 0.2117665418227216 visualization 0.17493757802746568 between 0.1487203495630462 novel 0.09784644194756555 promising 0.0780274656679151 energy 0.075374531835206 binding 0.07467228464419476 cell 0.060549313358302125 activity 0.05149812734082397 stability 0.0392478152309613 performance 0.03394194756554307 including 0.021067415730337078 effective 0.018414481897627965 synthesized 0.01802434456928839 interaction 0.016619850187265917 experimental 0.015761548064918852 development 0.015605493133583021 mechanism 0.015605493133583021 protein 0.009831460674157303 enhanced 0.006008114856429463 strong 6.242197253433209E-4 synthesis 0.0
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