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Application

Discovery Studio 0.8469846275128105 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0688997244011024 Amorphous Cell 0.2860928556285775 Blends 0.0025439898240407037 CASTEP 0.3966504133983464 CDOCKER 0.14776340894636422 CHARMm 0.23425906296374815 COMPASS 0.37121051515793935 COMPASS III 0.0870256518973924 COSMObase 0.0037099851600593597 COSMOconf 0.0044519821920712315 COSMOmic 1.0599957600169599E-4 COSMOperm 0.001377994488022048 COSMOplex 2.1199915200339198E-4 COSMOquick 0.001483994064023744 COSMOtherm 0.06497774008903964 Cantera 0.0 Catalyst 0.09942760228959084 Classical Simulations 1.0 Conformers 7.41997032011872E-4 Crystallization 0.0767436930252279 DFTB Plus 0.005723977104091583 DMol3 0.17765528937884248 DPD 0.002437990248039008 Discover 0.0033919864320542717 Forcite 0.5511977952088192 GULP 0.024485902056391774 Kinetix 2.1199915200339198E-4 LUDI 0.0031799872800508796 LibDock 0.06285774856900572 LigandFit 0.0038159847360610556 MCSS 4.2399830400678397E-4 MODELER 0.18899724401102397 MesoDyn 0.00105999576001696 Mesocite 0.0034979860080559676 Mesoscale 0.006571973712105152 Modules 0.0 Morphology 0.018337926648293406 ONETEP 0.00105999576001696 Polymorph 0.002013991944032224 QMERA 1.0599957600169599E-4 QSAR 0.00105999576001696 Quantum Mechanics 0.5628577485690057 Reflex 0.055755776976892095 Reflex Plus 9.539961840152639E-4 Semi-empirical 0.007631969472122111 Sorption 0.058299766800932795 Synthia 0.0015899936400254398 TURBOMOLE 5.2999788000848E-4 VAMP 0.0015899936400254398 Visualization 0.7297010811956752 X-Cell 0.001377994488022048 ZDOCK 0.024379902480390077

Year

2022 0.0 2023 0.24342163161137023 2024 0.6098741529525653 2025 1.0 2026 0.37481298952741354 2027 7.040394262078677E-4

Keywords

target 1.0 potential 0.27883211678832115 docking 0.19420924574209245 analysis 0.1908029197080292 visualization 0.1745498783454988 between 0.157323600973236 energy 0.09712895377128954 novel 0.09576642335766423 cell 0.06564476885644768 promising 0.06335766423357664 binding 0.058637469586374696 activity 0.04199513381995134 performance 0.0413625304136253 stability 0.038880778588807785 experimental 0.03167883211678832 interaction 0.028613138686131388 synthesized 0.026228710462287103 effective 0.02024330900243309 mechanism 0.01902676399026764 including 0.017615571776155716 development 0.01688564476885645 synthesis 0.004866180048661801 protein 0.0031143552311435523 enhanced 0.0010218978102189782 design 0.0
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