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Application

Discovery Studio 1.0 Materials Studio 0.9764900662251655 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06769254093389933 Amorphous Cell 0.2758489993935719 Blends 0.002577319587628866 CASTEP 0.4165403274711947 CDOCKER 0.17806246209824136 CHARMm 0.2606882959369315 COMPASS 0.37181625227410553 COMPASS III 0.07375682231655549 COSMObase 0.002880533656761674 COSMOconf 0.0033353547604608852 COSMOmic 2.2741055184960583E-4 COSMOperm 0.001288659793814433 COSMOplex 3.0321406913280777E-4 COSMOquick 0.001440266828380837 COSMOtherm 0.06329593693147362 Cantera 7.580351728320194E-5 Catalyst 0.1248483929654336 Classical Simulations 1.0 Conformers 0.0011370527592480292 Crystallization 0.07557610673135233 DFTB Plus 0.005912674348089751 DMol3 0.19079745300181927 DPD 0.0029563371740448756 Discover 0.005003032140691328 Forcite 0.5309278350515464 GULP 0.026758641600970284 Kinetix 2.2741055184960583E-4 LUDI 0.0058368708308065495 LibDock 0.07178593086719223 LigandFit 0.007959369314736203 MCSS 0.001440266828380837 MODELER 0.19208611279563373 MesoDyn 0.0015160703456640388 Mesocite 0.004169193450576107 Mesoscale 0.007580351728320194 Modules 0.0 Morphology 0.01758641600970285 ONETEP 0.0011370527592480292 Polymorph 0.0019708914493632504 QMERA 2.2741055184960583E-4 QSAR 0.001440266828380837 Quantum Mechanics 0.594602789569436 Reflex 0.05563978168587022 Reflex Plus 6.822316555488174E-4 Semi-empirical 0.008035172832019405 Sorption 0.05419951485748939 Synthia 0.001440266828380837 TURBOMOLE 5.306246209824135E-4 VAMP 0.0017434808975136447 Visualization 0.8892510612492419 X-Cell 0.0011370527592480292 ZDOCK 0.03077622801697999

Year

2020 3.3941450997030124E-4 2021 0.21654645736105219 2022 0.2922358930844294 2023 0.4106915570640645 2024 1.0 2025 0.9703860840050912 2026 0.36071277047093764 2027 0.0

Keywords

target 1.0 potential 0.261513575234712 docking 0.2152372494290789 visualization 0.21269982238010657 analysis 0.1783494037046435 between 0.15075488454706928 novel 0.09937198680537934 energy 0.08141969043390003 binding 0.06863740167470185 cell 0.05620400913473737 activity 0.05150976909413854 promising 0.04329484902309059 interaction 0.039171530068510534 experimental 0.028102004567368687 synthesized 0.02737249429078914 stability 0.025564577518396345 protein 0.018903831514843948 effective 0.01639812230398376 mechanism 0.016334686627759453 development 0.015287997970058361 performance 0.014146155798020806 synthesis 0.012528546054300939 including 0.007168231413346866 chemical 0.002981476782542502 design 0.0
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