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Application

Discovery Studio 1.0 Materials Studio 0.9891805887032618 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06583889816360601 Amorphous Cell 0.27639816360601 Blends 0.0025041736227045075 CASTEP 0.38251252086811355 CDOCKER 0.16642320534223706 CHARMm 0.26158180300500833 COMPASS 0.35715776293823037 COMPASS III 0.08441151919866444 COSMObase 0.0036519198664440736 COSMOconf 0.004382303839732888 COSMOmic 1.0434056761268782E-4 COSMOperm 0.0013564273789649416 COSMOplex 2.0868113522537563E-4 COSMOquick 0.0014607679465776294 COSMOtherm 0.06260434056761269 Cantera 0.0 Catalyst 0.12385225375626044 Classical Simulations 1.0 Conformers 7.303839732888147E-4 Crystallization 0.07345575959933222 DFTB Plus 0.005634390651085142 DMol3 0.17090984974958265 DPD 0.0023998330550918196 Discover 0.0032345575959933223 Forcite 0.532762938230384 GULP 0.023685308848080133 Kinetix 3.1302170283806343E-4 LUDI 0.004382303839732888 LibDock 0.0710559265442404 LigandFit 0.005634390651085142 MCSS 6.260434056761269E-4 MODELER 0.19303005008347246 MesoDyn 0.001043405676126878 Mesocite 0.00333889816360601 Mesoscale 0.006364774624373956 Modules 0.0 Morphology 0.01763355592654424 ONETEP 0.001043405676126878 Polymorph 0.0018781302170283807 QMERA 1.0434056761268782E-4 QSAR 0.001043405676126878 Quantum Mechanics 0.542779632721202 Reflex 0.05321368948247079 Reflex Plus 9.390651085141904E-4 Semi-empirical 0.007199499165275459 Sorption 0.05623956594323873 Synthia 0.0015651085141903172 TURBOMOLE 6.260434056761269E-4 VAMP 0.0012520868113522537 Visualization 0.8345158597662772 X-Cell 0.0013564273789649416 ZDOCK 0.028902337228714523

Year

2022 0.04415790868144485 2023 0.35767906031970326 2024 0.590832818157732 2025 1.0 2026 0.37543053960964407 2027 0.0

Keywords

target 1.0 potential 0.28672736423113876 docking 0.22670082810998765 visualization 0.20789678363910874 analysis 0.1972823351786613 between 0.15363499107837306 novel 0.103307864757286 energy 0.08715743240151896 binding 0.07635997620899483 promising 0.06281740403532049 cell 0.06277165210230132 activity 0.056046117948483326 stability 0.03838587180308368 interaction 0.0363727867502402 synthesized 0.03143157798416983 performance 0.029830260328498878 experimental 0.028183190739808756 development 0.02186942398316329 protein 0.02159491238504827 effective 0.021457656585990758 mechanism 0.0206341217916457 including 0.019536075399185615 synthesis 0.014777874365191929 design 0.0032941391773802444 chemical 0.0
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