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Application

Discovery Studio 1.0 Materials Studio 0.956560761084186 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0669793466633753 Amorphous Cell 0.2766395128774788 Blends 0.0025508104994651525 CASTEP 0.40023039578704844 CDOCKER 0.1788035875915412 CHARMm 0.26503743931539536 COMPASS 0.36402534353657534 COMPASS III 0.07677116761293508 COSMObase 0.003126799967086316 COSMOconf 0.003538221015387147 COSMOmic 1.6456841932033242E-4 COSMOperm 0.0013988315642228257 COSMOplex 2.4685262898049864E-4 COSMOquick 0.0013988315642228257 COSMOtherm 0.06278285197070682 Cantera 8.228420966016621E-5 Catalyst 0.12869250390849996 Classical Simulations 1.0 Conformers 9.874105159219946E-4 Crystallization 0.07397350448448943 DFTB Plus 0.005924463095531967 DMol3 0.18176581913930717 DPD 0.00304451575742615 Discover 0.003949642063687978 Forcite 0.5292520365341891 GULP 0.025837241833292193 Kinetix 2.4685262898049864E-4 LUDI 0.005759894676211635 LibDock 0.07323294659754793 LigandFit 0.007487863079075126 MCSS 0.0013165473545626593 MODELER 0.1892536822183823 MesoDyn 0.001563399983543158 Mesocite 0.004031926273348144 Mesoscale 0.007652431498395458 Modules 0.0 Morphology 0.01711511560931457 ONETEP 9.874105159219946E-4 Polymorph 0.001892536822183823 QMERA 2.4685262898049864E-4 QSAR 0.001151978935242327 Quantum Mechanics 0.5706409939932527 Reflex 0.0545544310046902 Reflex Plus 7.405578869414959E-4 Semi-empirical 0.007899284127375956 Sorption 0.053567020488768206 Synthia 0.0014811157738829918 TURBOMOLE 5.759894676211635E-4 VAMP 0.001563399983543158 Visualization 0.8848021064757673 X-Cell 0.001151978935242327 ZDOCK 0.030527441783921666

Year

2020 0.0 2021 0.11437822700621335 2022 0.2829264023803273 2023 0.37945217467401765 2024 0.9164260085761792 2025 1.0 2026 0.37262623610746476 2027 6.125842303316706E-4

Keywords

target 1.0 potential 0.268723233870687 docking 0.22185857038403956 visualization 0.21405939904599422 analysis 0.18272344277706207 between 0.1490895163817416 novel 0.10187667560321716 energy 0.07959332892308764 binding 0.07196824623098082 cell 0.057901883639149054 activity 0.0527488597193691 promising 0.04707356986177361 interaction 0.03836913756484802 synthesized 0.029734340726297832 stability 0.0278193656209742 experimental 0.026322203265902996 protein 0.021029908429372236 effective 0.017199958218724973 mechanism 0.01667769228090944 development 0.016538421364158628 performance 0.016538421364158628 synthesis 0.01274328888269907 including 0.010062323735245987 chemical 9.400786880679642E-4 design 0.0
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