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Application

Discovery Studio 0.9336054150905834 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0679344262295082 Amorphous Cell 0.28524590163934427 Blends 0.0024918032786885244 CASTEP 0.3881967213114754 CDOCKER 0.1635409836065574 CHARMm 0.24957377049180327 COMPASS 0.3656393442622951 COMPASS III 0.08445901639344262 COSMObase 0.003540983606557377 COSMOconf 0.004852459016393443 COSMOmic 1.3114754098360657E-4 COSMOperm 0.001180327868852459 COSMOplex 3.9344262295081965E-4 COSMOquick 9.180327868852459E-4 COSMOtherm 0.06596721311475409 Cantera 0.0 Catalyst 0.11121311475409836 Classical Simulations 1.0 Conformers 6.557377049180328E-4 Crystallization 0.07488524590163935 DFTB Plus 0.006295081967213114 DMol3 0.17731147540983608 DPD 0.003147540983606557 Discover 0.004327868852459016 Forcite 0.5438688524590164 GULP 0.022032786885245903 Kinetix 2.6229508196721314E-4 LUDI 0.004327868852459016 LibDock 0.06649180327868852 LigandFit 0.005377049180327869 MCSS 3.9344262295081965E-4 MODELER 0.18911475409836065 MesoDyn 0.001180327868852459 Mesocite 0.003934426229508197 Mesoscale 0.007344262295081967 Morphology 0.017311475409836064 ONETEP 0.001180327868852459 Polymorph 0.0022295081967213114 QMERA 2.6229508196721314E-4 QSAR 0.0010491803278688525 Quantum Mechanics 0.5555409836065573 Reflex 0.05455737704918033 Reflex Plus 5.245901639344263E-4 Semi-empirical 0.008131147540983607 Sorption 0.05573770491803279 Synthia 0.0013114754098360656 TURBOMOLE 5.245901639344263E-4 VAMP 0.0013114754098360656 Visualization 0.7774426229508197 X-Cell 0.0013114754098360656 ZDOCK 0.029245901639344263

Year

2022 0.13690550884678127 2023 0.26941899861965113 2024 0.7015936754925336 2025 1.0 2026 0.5180072782030367 2027 0.0

Keywords

target 1.0 potential 0.27742087581776387 docking 0.20893499145399894 analysis 0.1937290033594625 visualization 0.1869511404491071 between 0.15465315023280485 novel 0.09612777745034479 energy 0.08805327989626922 binding 0.06854482230211587 cell 0.06601049095302647 promising 0.06070607650144398 activity 0.049036364707962514 stability 0.03813284611304297 performance 0.03229799021630223 experimental 0.027936582778334412 synthesized 0.027936582778334412 interaction 0.0271703895797725 effective 0.020922968114575353 mechanism 0.019508457594153355 including 0.01726881593681853 development 0.015677491601343786 synthesis 0.009489008074497554 protein 0.007485118170566393 design 0.0023575175340366595 chemical 0.0
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