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Application

Discovery Studio 1.0 Materials Studio 0.9541936302499683 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06736068585425597 Amorphous Cell 0.2718922229026332 Blends 0.0027994051264106376 CASTEP 0.40013997025632053 CDOCKER 0.17741229988627416 CHARMm 0.26629341264981193 COMPASS 0.3649724433557869 COMPASS III 0.0774210480272942 COSMObase 0.0031493307672119677 COSMOconf 0.0037617006386142945 COSMOmic 2.624442306009973E-4 COSMOperm 0.0013122211530049864 COSMOplex 2.624442306009973E-4 COSMOquick 0.0016621467938063162 COSMOtherm 0.062461726883037354 Cantera 0.0 Catalyst 0.12396115825387105 Classical Simulations 1.0 Conformers 9.622955122036567E-4 Crystallization 0.07462164290088356 DFTB Plus 0.005598810252821275 DMol3 0.18222377744729246 DPD 0.0027994051264106376 Discover 0.0041116262794156245 Forcite 0.5281252733794068 GULP 0.02510716472749541 Kinetix 2.624442306009973E-4 LUDI 0.005336366022220278 LibDock 0.07304697751727758 LigandFit 0.007698364097629254 MCSS 0.0011372583326043216 MODELER 0.19578339602834396 MesoDyn 0.0013122211530049864 Mesocite 0.0037617006386142945 Mesoscale 0.007085994226226927 Modules 0.0 Morphology 0.01688391216866416 ONETEP 0.0013122211530049864 Polymorph 0.001837109614206981 QMERA 1.7496282040066485E-4 QSAR 0.0013122211530049864 Quantum Mechanics 0.5704662759163678 Reflex 0.0552882512466101 Reflex Plus 7.873326918029919E-4 Semi-empirical 0.007260957046627592 Sorption 0.05546321406701076 Synthia 0.0013997025632053188 TURBOMOLE 5.248884612019946E-4 VAMP 0.0013122211530049864 Visualization 0.8843495757151605 X-Cell 0.0013122211530049864 ZDOCK 0.031405826261919345

Year

2020 0.017162471395881007 2021 0.12920260517514523 2022 0.17549727160711143 2023 0.4051223376166168 2024 0.7976588628762542 2025 1.0 2026 0.37414187643020597 2027 0.0

Keywords

target 1.0 potential 0.27086649146833475 docking 0.22274863974534553 visualization 0.2153829070585187 analysis 0.18566088018654922 between 0.15160824665951067 novel 0.10182477699226412 energy 0.08128215567975719 binding 0.07424954658178184 cell 0.05748232594292482 activity 0.05470629603582929 promising 0.0510789502905578 interaction 0.0390865010919051 stability 0.02957397194359107 synthesized 0.028056408927712183 experimental 0.026390790983454863 protein 0.02143095088277751 mechanism 0.018914017100344228 effective 0.018358811118925122 development 0.01813672872635748 performance 0.017840618869600623 synthesis 0.014398341784802161 including 0.01136321575304438 design 0.0014805492837842839 chemical 0.0
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