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Application

Discovery Studio 1.0 Materials Studio 0.6464879852125693 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.044096728307254626 Amorphous Cell 0.2460881934566145 Blends 0.001422475106685633 CASTEP 0.21621621621621623 CDOCKER 0.21692745376955902 CHARMm 0.34210526315789475 COMPASS 0.30369843527738266 COMPASS III 0.10597439544807966 COSMObase 0.002844950213371266 COSMOconf 0.009246088193456615 COSMOmic 0.0 COSMOperm 7.112375533428165E-4 COSMOplex 7.112375533428165E-4 COSMOtherm 0.06116642958748222 Catalyst 0.09815078236130868 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07610241820768136 DFTB Plus 0.002844950213371266 DMol3 0.09957325746799431 DPD 0.001422475106685633 Discover 0.002844950213371266 Forcite 0.4743954480796586 GULP 0.007823613086770981 Kinetix 0.0 LUDI 0.0021337126600284497 LibDock 0.08677098150782361 LigandFit 0.002844950213371266 MODELER 0.3129445234708393 Mesocite 0.004267425320056899 Mesoscale 0.005689900426742532 Morphology 0.017780938833570414 ONETEP 0.001422475106685633 Polymorph 0.001422475106685633 Quantum Mechanics 0.3150782361308677 Reflex 0.05405405405405406 Reflex Plus 0.0 Semi-empirical 0.002844950213371266 Sorption 0.05689900426742532 Synthia 0.001422475106685633 TURBOMOLE 0.0 Visualization 0.8499288762446657 X-Cell 7.112375533428165E-4 ZDOCK 0.03627311522048364

Year

2024 0.0 2025 1.0 2026 0.6989342806394316 2027 0.004440497335701598

Keywords

target 1.0 potential 0.3438735177865613 docking 0.29347826086956524 analysis 0.23353096179183136 visualization 0.21113306982872201 binding 0.11067193675889328 between 0.10902503293807642 novel 0.10704874835309618 promising 0.10210803689064558 activity 0.08036890645586298 therapeutic 0.046442687747035576 cell 0.04512516469038208 stability 0.041501976284584984 including 0.03985507246376811 strong 0.0266798418972332 development 0.022727272727272728 energy 0.021409749670619236 protein 0.016798418972332016 mechanism 0.012845849802371542 synthesized 0.012516469038208168 effective 0.012187088274044796 strategy 0.009552042160737812 interaction 0.0029644268774703555 inhibition 0.0 silico 0.0
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