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Application

Discovery Studio 1.0 Materials Studio 0.9678612716763005 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0659679408138101 Amorphous Cell 0.27640772708590217 Blends 0.002466091245376079 CASTEP 0.3799835593916975 CDOCKER 0.17396218660090423 CHARMm 0.2665433621043979 COMPASS 0.35450061652281134 COMPASS III 0.08374434854089602 COSMObase 0.0035963830661734485 COSMOconf 0.004110152075626798 COSMOmic 2.055076037813399E-4 COSMOperm 0.0013357994245787094 COSMOplex 1.0275380189066995E-4 COSMOquick 0.0013357994245787094 COSMOtherm 0.061241265926839296 Cantera 0.0 Catalyst 0.1230990546650226 Classical Simulations 1.0 Conformers 9.247842170160296E-4 Crystallization 0.07244143033292232 DFTB Plus 0.0052404438964241675 DMol3 0.17108508014796547 DPD 0.002568845047266749 Discover 0.0033908754623921083 Forcite 0.5321619399917797 GULP 0.02342786683107275 Kinetix 3.0826140567200987E-4 LUDI 0.004829428688861488 LibDock 0.07203041512535964 LigandFit 0.005959720509658858 MCSS 8.220304151253596E-4 MODELER 0.19451294697903823 MesoDyn 0.0011302918207973696 Mesocite 0.0032881216605014385 Mesoscale 0.006473489519112207 Modules 0.0 Morphology 0.016954377311960544 ONETEP 0.0010275380189066995 Polymorph 0.0017468146321413893 QMERA 2.055076037813399E-4 QSAR 8.220304151253596E-4 Quantum Mechanics 0.540793259350596 Reflex 0.05312371557747637 Reflex Plus 9.247842170160296E-4 Semi-empirical 0.0068845047266748866 Sorption 0.05507603781339909 Synthia 0.0011302918207973696 TURBOMOLE 5.137690094533497E-4 VAMP 0.0012330456226880395 Visualization 0.8416563912864776 X-Cell 0.0013357994245787094 ZDOCK 0.028976572133168926

Year

2021 0.0010819583446037328 2022 0.13109728608781895 2023 0.3139482463258498 2024 0.6333964475701019 2025 1.0 2026 0.3832837435758723 2027 0.0

Keywords

target 1.0 potential 0.285368151837394 docking 0.2274420065509041 visualization 0.20909050118903397 analysis 0.19684120787903261 between 0.1517476555839727 novel 0.10589132678242921 energy 0.08404002333198726 binding 0.07771346524879975 cell 0.06304123480055637 promising 0.06079777448736932 activity 0.05613137703594023 interaction 0.03809395611791627 stability 0.036882487548795265 synthesized 0.031273836765827616 performance 0.028402207564948177 experimental 0.025620316776596222 effective 0.023062772019562975 protein 0.0211333961502221 mechanism 0.020953919325167138 development 0.01992192758110109 including 0.017857944092968994 synthesis 0.01386458473549603 design 0.00300623681967066 chemical 0.0
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