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Application

Discovery Studio 0.8645762711864406 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06837606837606838 Amorphous Cell 0.2873369320737742 Blends 0.002249212775528565 CASTEP 0.3825910931174089 CDOCKER 0.15317139001349528 CHARMm 0.23717948717948717 COMPASS 0.37044534412955465 COMPASS III 0.08895636527215475 COSMObase 0.004048582995951417 COSMOconf 0.004273504273504274 COSMOmic 2.249212775528565E-4 COSMOperm 0.001349527665317139 COSMOplex 2.249212775528565E-4 COSMOquick 0.0015744489428699954 COSMOtherm 0.06477732793522267 Catalyst 0.097953216374269 Classical Simulations 1.0 Conformers 8.99685110211426E-4 Crystallization 0.0752361673414305 DFTB Plus 0.005060728744939271 DMol3 0.1774628879892038 DPD 0.00258659469185785 Discover 0.003598740440845704 Forcite 0.5506072874493927 GULP 0.024853801169590642 Kinetix 2.249212775528565E-4 LUDI 0.003936122357174989 LibDock 0.06455240665766981 LigandFit 0.004610886189833558 MCSS 6.747638326585695E-4 MODELER 0.18960863697705804 MesoDyn 0.0014619883040935672 Mesocite 0.003936122357174989 Mesoscale 0.007197480881691408 Modules 0.0 Morphology 0.017768780926675665 ONETEP 7.872244714349977E-4 Polymorph 0.0016869095816464238 QMERA 2.249212775528565E-4 QSAR 8.99685110211426E-4 Quantum Mechanics 0.5486954565901935 Reflex 0.05510571300044984 Reflex Plus 0.0010121457489878543 Semi-empirical 0.006972559604138551 Sorption 0.05701754385964912 Synthia 0.0014619883040935672 TURBOMOLE 4.49842555105713E-4 VAMP 0.0014619883040935672 Visualization 0.7281826360773729 X-Cell 0.0014619883040935672 ZDOCK 0.025978407557354925

Year

2022 0.06251808972503618 2023 0.2010612638687892 2024 0.6168837433671008 2025 1.0 2026 0.4101302460202605 2027 0.0

Keywords

target 1.0 potential 0.27461113120768954 docking 0.1950286806883365 analysis 0.18970595834840576 visualization 0.17394449899230013 between 0.15616763991524985 novel 0.09694589426903003 energy 0.0930701255749057 cell 0.06511291406128883 promising 0.05948013022582812 binding 0.059170068730298175 activity 0.04082476357810966 performance 0.04061805591442303 stability 0.03705234871582864 experimental 0.030851118805229703 interaction 0.029145780579814998 synthesized 0.02558007338122061 effective 0.01994728954575991 including 0.018138597488501888 mechanism 0.017415120665598676 development 0.01684667459046044 protein 0.005684460751382358 synthesis 0.0052710454240090954 design 5.684460751382357E-4 enhanced 0.0
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