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Application

Discovery Studio 1.0 Materials Studio 0.9780028724771336 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06577356970185334 Amorphous Cell 0.278303787268332 Blends 0.002316680096696213 CASTEP 0.38980660757453667 CDOCKER 0.17042707493956485 CHARMm 0.26087832393231264 COMPASS 0.36079774375503626 COMPASS III 0.08370265914585012 COSMObase 0.003726833199033038 COSMOconf 0.004331184528605963 COSMOmic 1.007252215954875E-4 COSMOperm 0.0013094278807413377 COSMOplex 3.0217566478646255E-4 COSMOquick 0.0014101531023368251 COSMOtherm 0.06416196615632555 Cantera 0.0 Catalyst 0.12207896857373086 Classical Simulations 1.0 Conformers 7.050765511684126E-4 Crystallization 0.07312651087832393 DFTB Plus 0.0060435132957292505 DMol3 0.1758662369057212 DPD 0.0028203062046736503 Discover 0.0038275584206285255 Forcite 0.532030620467365 GULP 0.024476228847703466 Kinetix 2.01450443190975E-4 LUDI 0.0040290088638195 LibDock 0.07131345688960515 LigandFit 0.005136986301369863 MCSS 7.050765511684126E-4 MODELER 0.19842868654311038 MesoDyn 0.0014101531023368251 Mesocite 0.0040290088638195 Mesoscale 0.007252215954875101 Modules 0.0 Morphology 0.017224012892828364 ONETEP 0.001007252215954875 Polymorph 0.002115229653505238 QMERA 2.01450443190975E-4 QSAR 0.001007252215954875 Quantum Mechanics 0.5542908944399678 Reflex 0.0531829170024174 Reflex Plus 9.065269943593876E-4 Semi-empirical 0.007856567284448026 Sorption 0.05499597099113618 Synthia 0.0016116035455278 TURBOMOLE 4.0290088638195E-4 VAMP 0.0014101531023368251 Visualization 0.8498186946011281 X-Cell 0.0014101531023368251 ZDOCK 0.029713940370668816

Year

2021 0.031843676497195585 2022 0.15125746336167903 2023 0.29292563777817987 2024 0.6800253301972137 2025 1.0 2026 0.38447620770761715 2027 0.0

Keywords

target 1.0 potential 0.2811955385151621 docking 0.22638550017427675 visualization 0.20873997908678982 analysis 0.19318577901707912 between 0.1542784942488672 novel 0.10347682119205298 energy 0.08434994771697456 binding 0.07419832694318577 cell 0.062434646218194494 promising 0.05968978738236319 activity 0.054984315092366676 stability 0.03668525618682468 interaction 0.03555245730219589 synthesized 0.03211049146043918 experimental 0.029801324503311258 performance 0.02627222028581387 protein 0.021915301498780064 development 0.021043917741373302 effective 0.019475426978041128 mechanism 0.01877831997211572 including 0.017776228651097944 synthesis 0.013419309864064134 design 0.003485535029627048 chemical 0.0
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