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Application

Discovery Studio 1.0 Materials Studio 0.9388011367391448 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06648401826484018 Amorphous Cell 0.2765296803652968 Blends 0.002465753424657534 CASTEP 0.3926940639269406 CDOCKER 0.1817351598173516 CHARMm 0.2700456621004566 COMPASS 0.36146118721461185 COMPASS III 0.07662100456621004 COSMObase 0.0030136986301369864 COSMOconf 0.0037442922374429223 COSMOmic 1.8264840182648402E-4 COSMOperm 0.0013698630136986301 COSMOplex 2.73972602739726E-4 COSMOquick 0.0013698630136986301 COSMOtherm 0.06337899543378996 Cantera 0.0 Catalyst 0.13333333333333333 Classical Simulations 1.0 Conformers 8.219178082191781E-4 Crystallization 0.0736986301369863 DFTB Plus 0.006210045662100457 DMol3 0.17689497716894978 DPD 0.0031963470319634705 Discover 0.003561643835616438 Forcite 0.5268493150684932 GULP 0.025570776255707764 Kinetix 2.73972602739726E-4 LUDI 0.004931506849315068 LibDock 0.07406392694063926 LigandFit 0.006757990867579908 MCSS 0.001095890410958904 MODELER 0.18538812785388128 MesoDyn 0.0015525114155251142 Mesocite 0.0038356164383561643 Mesoscale 0.007579908675799087 Modules 0.0 Morphology 0.01762557077625571 ONETEP 0.001004566210045662 Polymorph 0.0018264840182648401 QMERA 1.8264840182648402E-4 QSAR 0.001187214611872146 Quantum Mechanics 0.5593607305936074 Reflex 0.05378995433789954 Reflex Plus 7.305936073059361E-4 Semi-empirical 0.00821917808219178 Sorption 0.05351598173515982 Synthia 0.0015525114155251142 TURBOMOLE 6.392694063926941E-4 VAMP 0.0016438356164383563 Visualization 0.8821917808219178 X-Cell 0.001187214611872146 ZDOCK 0.03123287671232877

Year

2021 0.04831183090859182 2022 0.24878762924329764 2023 0.3852136517522189 2024 0.8723579467471864 2025 1.0 2026 0.3200658797694208 2027 0.0

Keywords

target 1.0 potential 0.25988203831922924 docking 0.21595779756017144 visualization 0.2031358757372605 analysis 0.17478111147745173 between 0.14203025973550207 novel 0.099095138659926 energy 0.07425724438582995 binding 0.07202256658240833 cell 0.05626991977140345 activity 0.05260651353628604 promising 0.046708429497747006 interaction 0.0373667435981976 synthesized 0.030296369564421 stability 0.02747554676338059 experimental 0.024581455837637836 protein 0.02304282521888852 effective 0.01802395867677767 development 0.01725464336740301 mechanism 0.016741766494486575 synthesis 0.016082353372165438 performance 0.014433820566362604 including 0.012199142762940983 design 1.4653624940469647E-4 chemical 0.0
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