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Application

Discovery Studio 0.954438296848689 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0679903337469793 Amorphous Cell 0.26118476912024036 Antibody 2.612500816406505E-4 Blends 0.0027431258572268302 CASTEP 0.4367448239827575 CDOCKER 0.18045849389327934 CHARMm 0.275488211090066 COMPASS 0.36672980210306316 COMPASS III 0.06113251910391222 COSMObase 0.0025471882959963426 COSMOconf 0.003200313500097969 COSMOmic 1.959375612304879E-4 COSMOperm 0.0013062504082032526 COSMOplex 5.22500163281301E-4 COSMOquick 0.001763438051074391 COSMOtherm 0.06648814577754555 Cantera 6.531252041016262E-5 Catalyst 0.1550519234537261 Classical Simulations 1.0 Conformers 0.0011756253673829273 Crystallization 0.07563189863496832 DFTB Plus 0.005812814316504474 DMol3 0.20651818953693424 DPD 0.0046371889491215465 Discover 0.008033440010450003 Forcite 0.5029717196786624 GULP 0.03174188491933904 Kinetix 1.959375612304879E-4 LUDI 0.00849062765332114 LibDock 0.0706028345633858 LigandFit 0.017046567827052446 MCSS 0.0018287505714845536 MODELER 0.2417216380380119 MesoDyn 0.0025471882959963426 Mesocite 0.005420939194043498 Mesoscale 0.01045000326562602 Modules 0.0 Morphology 0.01861406831689635 ONETEP 0.002285938214355692 Polymorph 0.0023512507347658545 QMERA 6.531252041016263E-4 QSAR 0.001959375612304879 Quantum Mechanics 0.6296780092743779 Reflex 0.0545359545424858 Reflex Plus 0.0014368754490235779 Semi-empirical 0.00894781529619228 Sorption 0.0532950166546927 Synthia 0.0015021879694337404 TURBOMOLE 7.837502449219516E-4 VAMP 0.0023512507347658545 Visualization 0.7701652406766377 X-Cell 0.00124093788779309 ZDOCK 0.029390634184573182

Year

2013 0.0 2014 0.03430546937328251 2015 0.0616080134739828 2016 0.06674940164879001 2017 0.07180214519989363 2018 0.08589664036876163 2019 0.09963655704281535 2020 0.1107171350057619 2021 0.29509795230919245 2022 0.386401914723872 2023 0.5234465029695949 2024 0.7637620778299796 2025 1.0 2026 0.37762609697721833 2027 7.978016133321515E-4

Keywords

target 1.0 potential 0.22236076475477973 docking 0.17467442504848987 visualization 0.17007481296758103 between 0.15480742587974508 analysis 0.15311720698254364 novel 0.09287891382654474 energy 0.0799667497921862 binding 0.05968412302576891 cell 0.05092823496813522 activity 0.047908007758381825 interaction 0.034136880022166805 experimental 0.03258520365752286 promising 0.03117206982543641 synthesized 0.02147409254641175 mechanism 0.01571072319201995 protein 0.011942366306456082 stability 0.011499030202272097 performance 0.008451094486007204 development 0.007287337212524245 synthesis 0.005236907730673317 chemical 0.004793571626489333 design 0.004239401496259352 effective 3.602105846494874E-4 well 0.0
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